Compound ID |
Cluster
|
Compound Type
|
Target/Cell | Structure | Activity | Assay Description | Source | ||||
---|---|---|---|---|---|---|---|---|---|---|---|
Type
|
Relation
|
Value
|
Unit
|
||||||||
NAs.000956 | 2 | all-match | S-adenosylmethionine synthetase gamma form | ![]() |
Ki | = | 5500.0 | nM | Inhibitory constant against rat kidney Methionine adenosyltransferase II | CHEMBL1123521 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.37 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as SIIHRDLK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 1.03 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as SNNIFLHEDLTVK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.79 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as IGDFGLATVK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.62 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as DQIIFMVGR accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.82 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as GYLSPDLSK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.95 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as SASEPSLNR accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 1.14 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as TPIQAGGYGAFPVH accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Centromere-associated protein E | ![]() |
Other | > | 30.0 | % | Inhibition of porcine brain microtubule-stimulated human recombinant GST-tagged CENP-E ATPase activity at 1 mM by microplate reader in presence of Mg2+ ATP relative to control | CHEMBL3751740 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.72 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as QTAQGMDYLHAK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Chromosome-associated kinesin KIF4A | ![]() |
Other | > | 30.0 | % | Inhibition of porcine brain microtubule-stimulated human recombinant GST-tagged Kif4A ATPase activity at 1 mM by microplate reader in presence of Mg2+ ATP relative to control | CHEMBL3751740 | |
NAs.000956 | 2 | all-match | Kinesin-1 heavy chain | ![]() |
Other | > | 30.0 | % | Inhibition of porcine brain microtubule-stimulated human recombinant GST-tagged Kif5B ATPase activity at 1 mM by microplate reader in presence of Mg2+ ATP relative to control | CHEMBL3751740 | |
NAs.000956 | 2 | all-match | Kinesin-like protein KIF3C | ![]() |
Other | > | 30.0 | % | Inhibition of porcine brain microtubule-stimulated human recombinant GST-tagged KIF3C ATPase activity at 1 mM by microplate reader in presence of Mg2+ ATP relative to control | CHEMBL3751740 | |
NAs.000956 | 2 | all-match | Kinesin-like protein KIFC3 | ![]() |
Other | > | 30.0 | % | Inhibition of porcine brain microtubule-stimulated human recombinant GST-tagged KIFC3 ATPase activity at 1 mM by microplate reader in presence of Mg2+ ATP relative to control | CHEMBL3751740 | |
NAs.000956 | 2 | all-match | Kinesin-like protein KIF23 | ![]() |
Other | > | 30.0 | % | Inhibition of porcine brain microtubule-stimulated human recombinant GST-tagged MKLP1 ATPase activity at 1 mM by microplate reader in presence of Mg2+ ATP relative to control | CHEMBL3751740 | |
NAs.000956 | 2 | all-match | Heat shock protein HSP 90-alpha | ![]() |
Other | None | None | None | Binding affinity to 1H/13C-Ile HSP90alpha CTD (unknown origin) at 2.5 mM by Methyl-TROSY 15N HSQC spectrum analysis | CHEMBL4257528 | |
NAs.000956 | 2 | all-match | Sensor protein kinase WalK | ![]() |
IC50 | = | 228000.0 | nM | Inhibition of Streptococcus pneumoniae VicK autophosphorylation using compound at non-aggregating concentration after 30 mins in presence of [gamma-33P]-ATP by phosphorescence-based assay | CHEMBL4270516 | |
NAs.000956 | 2 | all-match | Casein kinase II alpha | ![]() |
Other | None | None | None | Binding affinity to CK2alpha (unknown origin) at 500 uM by STD-based NMR spectroscopy | CHEMBL4411337 | |
NAs.000956 | 2 | all-match | Unchecked | ![]() |
Other | None | None | % | Inhibition of recombinant human RAD51/p53 (unknown origin) interaction at 200 uM measured by ELISA assay | CHEMBL5113497 | |
NAs.000956 | 2 | all-match | Kinesin-like protein 1 | ![]() |
Other | > | 30.0 | % | Inhibition of porcine brain microtubule-stimulated human recombinant GST-tagged Eg5 ATPase activity at 1 mM by microplate reader in presence of Mg2+ ATP relative to control | CHEMBL3751740 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.55 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as LIDIAR accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Unchecked | ![]() |
IC50 | = | 48170.0 | nM | Inhibition of Thermotoga maritima HK853 autophosphorylation using compound at non-aggregating concentration after 30 mins in presence of [gamma-33P]-ATP by phosphorescence-based assay | CHEMBL4270516 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.67 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as WHGDVAVK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Ki | = | 4000.0 | nM | Inhibitory constant against rat Methionine adenosyltransferase was reported | CHEMBL1123521 | |
NAs.000956 | 2 | all-match | S-adenosylmethionine synthetase gamma form | ![]() |
Other | = | 25.5 | None | Inhibitory potency against rat Methionine adenosyltransferase II | CHEMBL1123521 | |
NAs.000956 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Other | = | 35.0 | None | Inhibitory potency against rat Methionine adenosyltransferase was reported | CHEMBL1123521 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.46 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as NEVGVLR accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Other | = | 1.4 | None | Relative inhibitory potency T/II in rat methionine adenosyltransferase | CHEMBL1123521 | |
NAs.000956 | 2 | all-match | Glycerol kinase | ![]() |
Ki | = | 900000.0 | nM | Tested for its binding affinity against glycerol kinase (ATP competitive inhibition) | CHEMBL1130575 | |
NAs.000956 | 2 | all-match | No relevant target | ![]() |
Other | = | 7.7 | None | pKa value was evaluated | CHEMBL1130575 | |
NAs.000956 | 2 | all-match | Unchecked | ![]() |
Ki | = | 14200.0 | nM | Inhibition of APH(3')-3a by PK/LDH-coupled assay | CHEMBL1255466 | |
NAs.000956 | 2 | all-match | Unchecked | ![]() |
Ki | = | 263000.0 | nM | Inhibition of aminoglycoside 3'-phosphotransferase 1B by PK/LDH-coupled assay | CHEMBL1255466 | |
NAs.000956 | 2 | all-match | Unchecked | ![]() |
Ki | None | None | None | Inhibition of macrolide 2'-phosphotransferase 1 by PK/LDH-coupled assay | CHEMBL1255466 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.83 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as SPQKPIVR accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.91 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as VFLPNK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.89 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as 7VVPAR accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.76 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as DSLKK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 1.0 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as SIPIPQPFRPADEDHR accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.98 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as GDGGSTTGLSATPPASLPGSLTNVK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.71 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as DSSDDWEIPDGQITVGQR accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | Serine/threonine-protein kinase B-raf | ![]() |
Other | = | 0.83 | None | Binding affinity to recombinant human full-length wild type B-Raf (unknown origin) assessed as IGSGSFGTVYK accessible protease cleavage peptide level by LC-MS/MS analysis relative to control | CHEMBL3414549 | |
NAs.000956 | 2 | all-match | No relevant target | ![]() |
Other | = | 7.7 | None | Conversion of compound to its pyrophosphate assessed as acid dissociation constant (second deprotonation) | CHEMBL3217618 | |
NAs.001630 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Ki | = | 2700.0 | nM | Compound was tested for inhibition constant with kidney form of M-T variants of Rat methionine adenosyltransferase when Methionine was the variable substrate | CHEMBL1124617 | |
NAs.001630 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Ki | = | 270.0 | nM | Compound was tested for inhibition constant with kidney form of M-2 variants of Rat methionine adenosyltransferase when ATP was the variable substrate | CHEMBL1124617 | |
NAs.001630 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Ki | = | 5400.0 | nM | Compound was tested for inhibition constant with kidney form of M-2 variants of Rat methionine adenosyltransferase when Methionine was the variable substrate | CHEMBL1124617 | |
NAs.001630 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Ki | = | 410.0 | nM | Compound was tested for inhibition constant with kidney form of M-T variants of Rat methionine adenosyltransferase when ATP was the variable substrate | CHEMBL1124617 | |
NAs.002242 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Ki | = | 630.0 | nM | Inhibition constant of ATP varied compound was measured on MT variant methionine adenosyltransferase in rat ascitic hepatoma cells | CHEMBL1124309 | |
NAs.002242 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Ki | = | 2700.0 | nM | Inhibition constant of Met varied compound was measured on MT variant methionine adenosyltransferase in rat ascitic hepatoma cells | CHEMBL1124309 | |
NAs.002242 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Ki | = | 390.0 | nM | Inhibition constant of ATP varied compound was measured on M-2 variate methionine adenosyltransferase in rat kidney | CHEMBL1124309 | |
NAs.002242 | 2 | all-match | S-adenosylmethionine synthetase (MAT 1 and MAT 2) | ![]() |
Ki | = | 2200.0 | nM | Inhibition constant of Met varied compound was measured on M-2 variant methionine adenosyltransferase in rat kidney | CHEMBL1124309 |