Found 104 hits with Last Name = 'kulkarni-almeida' and Initial = 'a' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Cyclin-dependent kinase 1
(Homo sapiens (Human)) | BDBM50214095
(CHEMBL248713 | CHEMBL511394 | N-((5-(3-(5-fluoro-1...)Show SMILES CCNCc1cncc(c1)-c1cnc2n[nH]c(-c3nc4ccc(F)cc4[nH]3)c2c1 Show InChI InChI=1S/C21H18FN7/c1-2-23-8-12-5-13(10-24-9-12)14-6-16-19(28-29-20(16)25-11-14)21-26-17-4-3-15(22)7-18(17)27-21/h3-7,9-11,23H,2,8H2,1H3,(H,26,27)(H,25,28,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Life Sciences Limited
Curated by ChEMBL
| Assay Description
Inhibition of CDK1/cyclinB (unknown origin) |
Bioorg Med Chem 16: 7167-76 (2008)
Article DOI: 10.1016/j.bmc.2008.06.042
BindingDB Entry DOI: 10.7270/Q2FJ2GKB |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50262025
(3-(6-(2,4-difluorophenylamino)-1H-pyrazolo[3,4-b]p...)Show SMILES COc1ccc(cc1-c1n[nH]c2nc(Nc3ccc(F)cc3F)ccc12)C(=O)NN1CCOCC1 Show InChI InChI=1S/C24H22F2N6O3/c1-34-20-6-2-14(24(33)31-32-8-10-35-11-9-32)12-17(20)22-16-4-7-21(28-23(16)30-29-22)27-19-5-3-15(25)13-18(19)26/h2-7,12-13H,8-11H2,1H3,(H,31,33)(H2,27,28,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Life Sciences Limited
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha MAPK (unknown origin) |
Bioorg Med Chem 16: 7167-76 (2008)
Article DOI: 10.1016/j.bmc.2008.06.042
BindingDB Entry DOI: 10.7270/Q2FJ2GKB |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426742
(CHEMBL2322167)Show InChI InChI=1S/C16H18N4O2/c1-16(2,3)9-22-13-5-4-10(6-11(13)8-17)12-7-14(21)20-15(18)19-12/h4-7H,9H2,1-3H3,(H3,18,19,20,21) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426763
(CHEMBL2322147)Show SMILES CC(C)(COc1ccc(cc1C#N)-c1cc(=O)[nH]c(N)n1)C(O)=O Show InChI InChI=1S/C16H16N4O4/c1-16(2,14(22)23)8-24-12-4-3-9(5-10(12)7-17)11-6-13(21)20-15(18)19-11/h3-6H,8H2,1-2H3,(H,22,23)(H3,18,19,20,21) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426761
(CHEMBL2322149)Show SMILES Nc1nc(cc(=O)[nH]1)-c1ccc(OCc2ccc(cc2)C(O)=O)c(c1)C#N Show InChI InChI=1S/C19H14N4O4/c20-9-14-7-13(15-8-17(24)23-19(21)22-15)5-6-16(14)27-10-11-1-3-12(4-2-11)18(25)26/h1-8H,10H2,(H,25,26)(H3,21,22,23,24) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426769
(CHEMBL2322169)Show SMILES Nc1nc(cc(=O)[nH]1)-c1ccc(OCc2ccc(F)cc2)c(c1)C#N Show InChI InChI=1S/C18H13FN4O2/c19-14-4-1-11(2-5-14)10-25-16-6-3-12(7-13(16)9-20)15-8-17(24)23-18(21)22-15/h1-8H,10H2,(H3,21,22,23,24) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426760
(CHEMBL2322150)Show SMILES COC(=O)c1ccc(COc2ccc(cc2C#N)-c2cc(=O)[nH]c(N)n2)cc1 Show InChI InChI=1S/C20H16N4O4/c1-27-19(26)13-4-2-12(3-5-13)11-28-17-7-6-14(8-15(17)10-21)16-9-18(25)24-20(22)23-16/h2-9H,11H2,1H3,(H3,22,23,24,25) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426768
(CHEMBL2322170)Show SMILES Nc1nc(cc(=O)[nH]1)-c1ccc(OCc2ccccc2C(F)(F)F)c(c1)C#N Show InChI InChI=1S/C19H13F3N4O2/c20-19(21,22)14-4-2-1-3-12(14)10-28-16-6-5-11(7-13(16)9-23)15-8-17(27)26-18(24)25-15/h1-8H,10H2,(H3,24,25,26,27) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426759
(CHEMBL2322151)Show SMILES Nc1nc(cc(=O)[nH]1)-c1ccc(OCC2CCC(CC2)C(O)=O)c(c1)C#N |(13.46,-38.13,;14.8,-37.36,;16.13,-38.13,;17.47,-37.36,;17.46,-35.81,;16.13,-35.05,;16.12,-33.51,;14.8,-35.82,;18.8,-38.13,;20.12,-37.35,;21.46,-38.12,;21.46,-39.66,;22.8,-40.43,;22.8,-41.97,;24.14,-42.74,;24.13,-44.27,;25.46,-45.04,;26.8,-44.27,;26.8,-42.73,;25.46,-41.95,;28.14,-45.04,;28.13,-46.58,;29.47,-44.27,;20.13,-40.44,;18.8,-39.67,;20.14,-41.97,;20.14,-43.51,)| Show InChI InChI=1S/C19H20N4O4/c20-9-14-7-13(15-8-17(24)23-19(21)22-15)5-6-16(14)27-10-11-1-3-12(4-2-11)18(25)26/h5-8,11-12H,1-4,10H2,(H,25,26)(H3,21,22,23,24) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426747
(CHEMBL2322162)Show SMILES COC(=O)C1CCC(COc2ccc(cc2C#N)-c2ccnc(N)n2)CC1 |(24.48,-22.25,;25.8,-21.48,;25.8,-19.96,;27.12,-19.19,;24.47,-19.2,;23.13,-19.97,;21.8,-19.21,;21.8,-17.66,;20.46,-16.9,;20.46,-15.36,;19.12,-14.59,;19.12,-13.04,;17.78,-12.28,;16.45,-13.05,;16.45,-14.59,;17.79,-15.36,;17.8,-16.9,;17.8,-18.44,;15.12,-12.28,;15.12,-10.73,;13.78,-9.97,;12.45,-10.74,;12.45,-12.28,;11.11,-13.05,;13.79,-13.05,;23.12,-16.89,;24.46,-17.65,)| Show InChI InChI=1S/C20H22N4O3/c1-26-19(25)14-4-2-13(3-5-14)12-27-18-7-6-15(10-16(18)11-21)17-8-9-23-20(22)24-17/h6-10,13-14H,2-5,12H2,1H3,(H2,22,23,24) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426746
(CHEMBL2322163)Show SMILES Nc1nccc(n1)-c1ccc(OCC2CCC(CC2)C(O)=O)c(c1)C#N |(11.11,-13.05,;12.45,-12.28,;12.45,-10.74,;13.78,-9.97,;15.12,-10.73,;15.12,-12.28,;13.79,-13.05,;16.45,-13.05,;17.78,-12.28,;19.12,-13.04,;19.12,-14.59,;20.46,-15.36,;20.46,-16.9,;21.8,-17.66,;21.8,-19.21,;23.13,-19.97,;24.47,-19.2,;24.46,-17.65,;23.12,-16.89,;25.8,-19.96,;25.8,-21.48,;27.12,-19.19,;17.79,-15.36,;16.45,-14.59,;17.8,-16.9,;17.8,-18.44,)| Show InChI InChI=1S/C19H20N4O3/c20-10-15-9-14(16-7-8-22-19(21)23-16)5-6-17(15)26-11-12-1-3-13(4-2-12)18(24)25/h5-9,12-13H,1-4,11H2,(H,24,25)(H2,21,22,23) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426744
(CHEMBL2322165)Show InChI InChI=1S/C17H20N4O2/c1-3-11(4-2)10-23-15-6-5-12(7-13(15)9-18)14-8-16(22)21-17(19)20-14/h5-8,11H,3-4,10H2,1-2H3,(H3,19,20,21,22) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426764
(CHEMBL2322146)Show SMILES Nc1nc(cc(=O)[nH]1)-c1ccc(OCC2CCCCC2)c(c1)C#N Show InChI InChI=1S/C18H20N4O2/c19-10-14-8-13(15-9-17(23)22-18(20)21-15)6-7-16(14)24-11-12-4-2-1-3-5-12/h6-9,12H,1-5,11H2,(H3,20,21,22,23) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426767
(CHEMBL2322171)Show SMILES Nc1nc(cc(=O)[nH]1)-c1ccc(OCc2ccc(F)cc2C(F)(F)F)c(c1)C#N Show InChI InChI=1S/C19H12F4N4O2/c20-13-3-1-11(14(6-13)19(21,22)23)9-29-16-4-2-10(5-12(16)8-24)15-7-17(28)27-18(25)26-15/h1-7H,9H2,(H3,25,26,27,28) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426743
(CHEMBL2322166)Show InChI InChI=1S/C16H18N4O2/c1-9(2)10(3)22-14-5-4-11(6-12(14)8-17)13-7-15(21)20-16(18)19-13/h4-7,9-10H,1-3H3,(H3,18,19,20,21) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426762
(CHEMBL2322148)Show SMILES COC(=O)C(C)(C)COc1ccc(cc1C#N)-c1cc(=O)[nH]c(N)n1 Show InChI InChI=1S/C17H18N4O4/c1-17(2,15(23)24-3)9-25-13-5-4-10(6-11(13)8-18)12-7-14(22)21-16(19)20-12/h4-7H,9H2,1-3H3,(H3,19,20,21,22) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426741
(CHEMBL2322168)Show SMILES Nc1nc(cc(=O)[nH]1)-c1ccc(OCc2ccccc2)c(c1)C#N Show InChI InChI=1S/C18H14N4O2/c19-10-14-8-13(15-9-17(23)22-18(20)21-15)6-7-16(14)24-11-12-4-2-1-3-5-12/h1-9H,11H2,(H3,20,21,22,23) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426765
(CHEMBL2322145)Show InChI InChI=1S/C16H16N4O2/c17-8-12-6-11(13-7-15(21)20-16(18)19-13)4-5-14(12)22-9-10-2-1-3-10/h4-7,10H,1-3,9H2,(H3,18,19,20,21) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426766
(CHEMBL2322144)Show SMILES CC(C)(C)c1ccc(COc2ccc(cc2C#N)-c2cc(=O)[nH]c(N)n2)cc1 Show InChI InChI=1S/C22H22N4O2/c1-22(2,3)17-7-4-14(5-8-17)13-28-19-9-6-15(10-16(19)12-23)18-11-20(27)26-21(24)25-18/h4-11H,13H2,1-3H3,(H3,24,25,26,27) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426758
(CHEMBL2322152)Show SMILES COC(=O)C1CCC(COc2ccc(cc2C#N)-c2cc(=O)[nH]c(N)n2)CC1 |(39.78,-47.2,;41.12,-46.43,;41.12,-44.89,;42.45,-44.12,;39.78,-44.12,;38.44,-44.89,;37.12,-44.13,;37.12,-42.59,;35.79,-41.82,;35.78,-40.28,;34.45,-39.52,;34.44,-37.97,;33.1,-37.21,;31.78,-37.98,;31.78,-39.52,;33.11,-40.29,;33.12,-41.83,;33.12,-43.37,;30.45,-37.21,;30.44,-35.66,;29.11,-34.9,;29.1,-33.36,;27.78,-35.67,;27.78,-37.21,;26.44,-37.98,;29.11,-37.98,;38.44,-41.81,;39.78,-42.58,)| Show InChI InChI=1S/C20H22N4O4/c1-27-19(26)13-4-2-12(3-5-13)11-28-17-7-6-14(8-15(17)10-21)16-9-18(25)24-20(22)23-16/h6-9,12-13H,2-5,11H2,1H3,(H3,22,23,24,25) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50320491
(2-(3-CYANO-4-ISOBUTOXY-PHENYL)-4-METHYL-5-THIAZOLE...)Show InChI InChI=1S/C16H16N2O3S/c1-9(2)8-21-13-5-4-11(6-12(13)7-17)15-18-10(3)14(22-15)16(19)20/h4-6,9H,8H2,1-3H3,(H,19,20) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402272
(CHEMBL2205509)Show InChI InChI=1S/C15H16N4O2/c1-9(2)8-21-13-4-3-10(5-11(13)7-16)12-6-14(20)19-15(17)18-12/h3-6,9H,8H2,1-2H3,(H3,17,18,19,20) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50320491
(2-(3-CYANO-4-ISOBUTOXY-PHENYL)-4-METHYL-5-THIAZOLE...)Show InChI InChI=1S/C16H16N2O3S/c1-9(2)8-21-13-5-4-11(6-12(13)7-17)15-18-10(3)14(22-15)16(19)20/h4-6,9H,8H2,1-3H3,(H,19,20) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426748
(CHEMBL2322161)Show InChI InChI=1S/C18H20N4O/c19-11-15-10-14(16-8-9-21-18(20)22-16)6-7-17(15)23-12-13-4-2-1-3-5-13/h6-10,13H,1-5,12H2,(H2,20,21,22) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426755
(CHEMBL2321880)Show InChI InChI=1S/C15H15N3O2/c1-10(2)8-20-14-4-3-11(5-12(14)7-16)13-6-15(19)18-9-17-13/h3-6,9-10H,8H2,1-2H3,(H,17,18,19) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426751
(CHEMBL2322158)Show SMILES Nc1nccc(n1)-c1ccc(OCc2ccccc2C(F)(F)F)c(c1)C#N Show InChI InChI=1S/C19H13F3N4O/c20-19(21,22)15-4-2-1-3-13(15)11-27-17-6-5-12(9-14(17)10-23)16-7-8-25-18(24)26-16/h1-9H,11H2,(H2,24,25,26) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Retinoblastoma-associated protein
(Homo sapiens (Human)) | BDBM2579
((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB
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Padmashri Vikhe Patil College of Arts
Curated by ChEMBL
| Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay |
Eur J Med Chem 134: 366-378 (2017)
Article DOI: 10.1016/j.ejmech.2017.02.062
BindingDB Entry DOI: 10.7270/Q2MW2KKK |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426750
(CHEMBL2322159)Show SMILES Nc1nccc(n1)-c1ccc(OCc2ccc(F)cc2C(F)(F)F)c(c1)C#N Show InChI InChI=1S/C19H12F4N4O/c20-14-3-1-12(15(8-14)19(21,22)23)10-28-17-4-2-11(7-13(17)9-24)16-5-6-26-18(25)27-16/h1-8H,10H2,(H2,25,26,27) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426753
(CHEMBL2322156)Show InChI InChI=1S/C15H16N4O/c1-10(2)9-20-14-4-3-11(7-12(14)8-16)13-5-6-18-15(17)19-13/h3-7,10H,9H2,1-2H3,(H2,17,18,19) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM5768
((4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)(phenyl)m...)Show InChI InChI=1S/C17H17N3O2/c1-2-3-9-22-16-13(10-18-17-14(16)11-19-20-17)15(21)12-7-5-4-6-8-12/h4-8,10-11H,2-3,9H2,1H3,(H,18,19,20) | PDB
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Piramal Life Sciences Limited
Curated by ChEMBL
| Assay Description
Inhibition of CDK2 (unknown origin) |
Bioorg Med Chem 16: 7167-76 (2008)
Article DOI: 10.1016/j.bmc.2008.06.042
BindingDB Entry DOI: 10.7270/Q2FJ2GKB |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402273
(CHEMBL2205508)Show SMILES CC(C)COc1ccc(cc1[N+]([O-])=O)-c1cc(=O)[nH]c(N)n1 Show InChI InChI=1S/C14H16N4O4/c1-8(2)7-22-12-4-3-9(5-11(12)18(20)21)10-6-13(19)17-14(15)16-10/h3-6,8H,7H2,1-2H3,(H3,15,16,17,19) | PDB
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| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426752
(CHEMBL2322157)Show InChI InChI=1S/C18H13FN4O/c19-15-4-1-12(2-5-15)11-24-17-6-3-13(9-14(17)10-20)16-7-8-22-18(21)23-16/h1-9H,11H2,(H2,21,22,23) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426745
(CHEMBL2322164)Show InChI InChI=1S/C12H10N4O2/c1-18-10-3-2-7(4-8(10)6-13)9-5-11(17)16-12(14)15-9/h2-5H,1H3,(H3,14,15,16,17) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402280
(CHEMBL2205501)Show InChI InChI=1S/C16H13N3O/c17-16-18-14(10-15(20)19-16)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-10H,(H3,17,18,19,20) | PDB
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| n/a | n/a | 310 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426749
(CHEMBL2322160)Show InChI InChI=1S/C16H16N4O/c17-9-13-8-12(14-6-7-19-16(18)20-14)4-5-15(13)21-10-11-2-1-3-11/h4-8,11H,1-3,10H2,(H2,18,19,20) | PDB
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Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50426757
(CHEMBL2322153)Show InChI InChI=1S/C16H16N4O3/c1-9(2)8-23-14-4-3-10(5-11(14)7-17)12-6-13(15(21)22)20-16(18)19-12/h3-6,9H,8H2,1-2H3,(H,21,22)(H2,18,19,20) | PDB
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| n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase-mediated uric acid production after 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 23: 834-8 (2013)
Article DOI: 10.1016/j.bmcl.2012.11.057
BindingDB Entry DOI: 10.7270/Q28W3FMN |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402288
(CHEMBL2205498)Show InChI InChI=1S/C14H17N3O2/c1-9(2)8-19-11-5-3-10(4-6-11)12-7-13(18)17-14(15)16-12/h3-7,9H,8H2,1-2H3,(H3,15,16,17,18) | PDB
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| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402274
(CHEMBL2205507)Show InChI InChI=1S/C15H19N3O3/c1-9(2)8-21-12-5-4-10(6-13(12)20-3)11-7-14(19)18-15(16)17-11/h4-7,9H,8H2,1-3H3,(H3,16,17,18,19) | PDB
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| n/a | n/a | 950 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50381872
(CHEMBL2022883)Show InChI InChI=1S/C12H13N3O2S/c1-16-9-4-3-7(5-10(9)17-2)8-6-11(18)15-12(13)14-8/h3-6H,1-2H3,(H3,13,14,15,18) | PDB
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| Article
PubMed
| n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis |
Bioorg Med Chem 20: 2930-9 (2012)
Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402284
(CHEMBL2205495)Show InChI InChI=1S/C14H17N3OS/c1-2-3-8-19-11-6-4-10(5-7-11)12-9-13(18)17-14(15)16-12/h4-7,9H,2-3,8H2,1H3,(H3,15,16,17,18) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.63E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402275
(CHEMBL2205506)Show InChI InChI=1S/C15H18N4O3/c1-8(2)7-22-12-4-3-9(5-10(12)14(16)21)11-6-13(20)19-15(17)18-11/h3-6,8H,7H2,1-2H3,(H2,16,21)(H3,17,18,19,20) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.92E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Retinoblastoma-associated protein
(Homo sapiens (Human)) | BDBM50251835
(CHEMBL4092194)Show InChI InChI=1S/C19H26N2/c1-12-3-5-14(9-12)20-15-6-7-16-17-10-13(2)4-8-18(17)21-19(16)11-15/h4,8,10,12,14-15,20-21H,3,5-7,9,11H2,1-2H3 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Padmashri Vikhe Patil College of Arts
Curated by ChEMBL
| Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay |
Eur J Med Chem 134: 366-378 (2017)
Article DOI: 10.1016/j.ejmech.2017.02.062
BindingDB Entry DOI: 10.7270/Q2MW2KKK |
More data for this
Ligand-Target Pair | |
Retinoblastoma-associated protein
(Homo sapiens (Human)) | BDBM50251835
(CHEMBL4092194)Show InChI InChI=1S/C19H26N2/c1-12-3-5-14(9-12)20-15-6-7-16-17-10-13(2)4-8-18(17)21-19(16)11-15/h4,8,10,12,14-15,20-21H,3,5-7,9,11H2,1-2H3 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Padmashri Vikhe Patil College of Arts
Curated by ChEMBL
| Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay |
Eur J Med Chem 134: 366-378 (2017)
Article DOI: 10.1016/j.ejmech.2017.02.062
BindingDB Entry DOI: 10.7270/Q2MW2KKK |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402287
(CHEMBL2205497)Show InChI InChI=1S/C14H17N3O2/c1-2-3-8-19-11-6-4-10(5-7-11)12-9-13(18)17-14(15)16-12/h4-7,9H,2-3,8H2,1H3,(H3,15,16,17,18) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Retinoblastoma-associated protein
(Homo sapiens (Human)) | BDBM50251836
(CHEMBL4070561)Show InChI InChI=1S/C20H22N2.ClH/c1-14-7-10-19-18(11-14)17-9-8-16(12-20(17)22-19)21-13-15-5-3-2-4-6-15;/h2-7,10-11,16,21-22H,8-9,12-13H2,1H3;1H | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Padmashri Vikhe Patil College of Arts
Curated by ChEMBL
| Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay |
Eur J Med Chem 134: 366-378 (2017)
Article DOI: 10.1016/j.ejmech.2017.02.062
BindingDB Entry DOI: 10.7270/Q2MW2KKK |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402286
(CHEMBL2205496)Show InChI InChI=1S/C13H15N3OS/c1-8(2)18-10-5-3-9(4-6-10)11-7-12(17)16-13(14)15-11/h3-8H,1-2H3,(H3,14,15,16,17) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.44E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402278
(CHEMBL2205503)Show InChI InChI=1S/C16H13N3O2/c17-16-18-14(10-15(20)19-16)11-6-8-13(9-7-11)21-12-4-2-1-3-5-12/h1-10H,(H3,17,18,19,20) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.47E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
Retinoblastoma-associated protein
(Homo sapiens (Human)) | BDBM50251866
(CHEMBL4070208)Show SMILES Cl.Cc1ccc(CNC2CCc3c(C2)[nH]c2ccc(C)cc32)cc1 Show InChI InChI=1S/C21H24N2.ClH/c1-14-3-6-16(7-4-14)13-22-17-8-9-18-19-11-15(2)5-10-20(19)23-21(18)12-17;/h3-7,10-11,17,22-23H,8-9,12-13H2,1-2H3;1H | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Padmashri Vikhe Patil College of Arts
Curated by ChEMBL
| Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay |
Eur J Med Chem 134: 366-378 (2017)
Article DOI: 10.1016/j.ejmech.2017.02.062
BindingDB Entry DOI: 10.7270/Q2MW2KKK |
More data for this
Ligand-Target Pair | |
Retinoblastoma-associated protein
(Homo sapiens (Human)) | BDBM50251841
(CHEMBL4068198)Show InChI InChI=1S/C21H24N2/c1-15-7-9-16(10-8-15)14-22-17-11-12-19-18-5-3-4-6-20(18)23(2)21(19)13-17/h3-10,17,22H,11-14H2,1-2H3 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Padmashri Vikhe Patil College of Arts
Curated by ChEMBL
| Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay |
Eur J Med Chem 134: 366-378 (2017)
Article DOI: 10.1016/j.ejmech.2017.02.062
BindingDB Entry DOI: 10.7270/Q2MW2KKK |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50402281
(CHEMBL2205502)Show InChI InChI=1S/C17H15N3O/c18-17-19-15(11-16(21)20-17)14-8-6-13(7-9-14)10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H3,18,19,20,21) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Piramal Healthcare Limited
Curated by ChEMBL
| Assay Description
Inhibition of xanthine oxidase using xanthine as substrate at 30 mins by spectrophotometric analysis |
Bioorg Med Chem Lett 22: 7543-6 (2012)
Article DOI: 10.1016/j.bmcl.2012.10.029
BindingDB Entry DOI: 10.7270/Q2445NNH |
More data for this
Ligand-Target Pair | |
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