Found 21 hits of Enzyme Inhibition Constant Data 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 |
|---|
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348312
(CHEMBL1800222 | US8772288, 12)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)Nc1ccon1 Show InChI InChI=1S/C23H21N3O3/c1-14-4-5-16(21(27)25-20-8-11-29-26-20)12-17(14)15-6-7-18-19(13-15)24-22(28)23(18)9-2-3-10-23/h4-8,11-13H,2-3,9-10H2,1H3,(H,24,28)(H,25,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.220 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348323
(CHEMBL1800912)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCCC2)c1)C(=O)NC1CC1 Show InChI InChI=1S/C24H26N2O2/c1-15-5-6-17(22(27)25-18-8-9-18)13-19(15)16-7-10-20-21(14-16)26-23(28)24(20)11-3-2-4-12-24/h5-7,10,13-14,18H,2-4,8-9,11-12H2,1H3,(H,25,27)(H,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.900 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348319
(CHEMBL1800916 | US8772288, 15)Show SMILES Cc1c(F)cc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)NC1CC1 Show InChI InChI=1S/C23H23FN2O2/c1-13-17(10-15(11-19(13)24)21(27)25-16-5-6-16)14-4-7-18-20(12-14)26-22(28)23(18)8-2-3-9-23/h4,7,10-12,16H,2-3,5-6,8-9H2,1H3,(H,25,27)(H,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348324
(CHEMBL1800910 | US8772288, 3)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCC2)c1)C(=O)NC1CC1 Show InChI InChI=1S/C22H22N2O2/c1-13-3-4-15(20(25)23-16-6-7-16)11-17(13)14-5-8-18-19(12-14)24-21(26)22(18)9-2-10-22/h3-5,8,11-12,16H,2,6-7,9-10H2,1H3,(H,23,25)(H,24,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348322
(CHEMBL1800913)Show SMILES Clc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)NC1CC1 Show InChI InChI=1S/C22H21ClN2O2/c23-18-8-4-14(20(26)24-15-5-6-15)11-16(18)13-3-7-17-19(12-13)25-21(27)22(17)9-1-2-10-22/h3-4,7-8,11-12,15H,1-2,5-6,9-10H2,(H,24,26)(H,25,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348326
(CHEMBL1800921)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)NCC1CC1 Show InChI InChI=1S/C24H26N2O2/c1-15-4-7-18(22(27)25-14-16-5-6-16)12-19(15)17-8-9-20-21(13-17)26-23(28)24(20)10-2-3-11-24/h4,7-9,12-13,16H,2-3,5-6,10-11,14H2,1H3,(H,25,27)(H,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348325
(CHEMBL1800909)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C2(C)C)c1)C(=O)NC1CC1 Show InChI InChI=1S/C21H22N2O2/c1-12-4-5-14(19(24)22-15-7-8-15)10-16(12)13-6-9-17-18(11-13)23-20(25)21(17,2)3/h4-6,9-11,15H,7-8H2,1-3H3,(H,22,24)(H,23,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348313
(CHEMBL1800221 | US8772288, 11)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)Nc1ccccn1 Show InChI InChI=1S/C25H23N3O2/c1-16-7-8-18(23(29)28-22-6-2-5-13-26-22)14-19(16)17-9-10-20-21(15-17)27-24(30)25(20)11-3-4-12-25/h2,5-10,13-15H,3-4,11-12H2,1H3,(H,27,30)(H,26,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348320
(CHEMBL1800915)Show SMILES Clc1cc2c(NC(=O)C22CCCC2)cc1-c1cccc(c1)C(=O)NC1CC1 Show InChI InChI=1S/C22H21ClN2O2/c23-18-12-17-19(25-21(27)22(17)8-1-2-9-22)11-16(18)13-4-3-5-14(10-13)20(26)24-15-6-7-15/h3-5,10-12,15H,1-2,6-9H2,(H,24,26)(H,25,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348318
(CHEMBL1800917 | US8772288, 6)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(N)=O Show InChI InChI=1S/C20H20N2O2/c1-12-4-5-14(18(21)23)10-15(12)13-6-7-16-17(11-13)22-19(24)20(16)8-2-3-9-20/h4-7,10-11H,2-3,8-9H2,1H3,(H2,21,23)(H,22,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348314
(CHEMBL1800220 | US8772288, 8)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)NC1CCC1 Show InChI InChI=1S/C24H26N2O2/c1-15-7-8-17(22(27)25-18-5-4-6-18)13-19(15)16-9-10-20-21(14-16)26-23(28)24(20)11-2-3-12-24/h7-10,13-14,18H,2-6,11-12H2,1H3,(H,25,27)(H,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348317
(CHEMBL1800918)Show SMILES CNC(=O)c1ccc(C)c(c1)-c1ccc2c(NC(=O)C22CCCC2)c1 Show InChI InChI=1S/C21H22N2O2/c1-13-5-6-15(19(24)22-2)11-16(13)14-7-8-17-18(12-14)23-20(25)21(17)9-3-4-10-21/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,22,24)(H,23,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348316
(CHEMBL1800919 | US8772288, 4)Show SMILES CC(C)NC(=O)c1ccc(C)c(c1)-c1ccc2c(NC(=O)C22CCCC2)c1 Show InChI InChI=1S/C23H26N2O2/c1-14(2)24-21(26)17-7-6-15(3)18(12-17)16-8-9-19-20(13-16)25-22(27)23(19)10-4-5-11-23/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,24,26)(H,25,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM13336
(4-[4-(4-fluorophenyl)-2-(4-methanesulfinylphenyl)-...)Show SMILES CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1 Show InChI InChI=1S/C21H16FN3OS/c1-27(26)18-8-4-16(5-9-18)21-24-19(14-2-6-17(22)7-3-14)20(25-21)15-10-12-23-13-11-15/h2-13H,1H3,(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | 55 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348321
(CHEMBL1800914)Show SMILES O=C(NC1CC1)c1cccc(c1)-c1ccc2c(NC(=O)C22CCCC2)c1 Show InChI InChI=1S/C22H22N2O2/c25-20(23-17-7-8-17)16-5-3-4-14(12-16)15-6-9-18-19(13-15)24-21(26)22(18)10-1-2-11-22/h3-6,9,12-13,17H,1-2,7-8,10-11H2,(H,23,25)(H,24,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348315
(CHEMBL1800920)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)NC(C)(C)C Show InChI InChI=1S/C24H28N2O2/c1-15-7-8-17(21(27)26-23(2,3)4)13-18(15)16-9-10-19-20(14-16)25-22(28)24(19)11-5-6-12-24/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,25,28)(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 275 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50348311
(CHEMBL1800223)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)Nc1nnc[nH]1 Show InChI InChI=1S/C22H21N5O2/c1-13-4-5-15(19(28)26-21-23-12-24-27-21)10-16(13)14-6-7-17-18(11-14)25-20(29)22(17)8-2-3-9-22/h4-7,10-12H,2-3,8-9H2,1H3,(H,25,29)(H2,23,24,26,27,28) | 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 | 1.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha by FRET assay |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Cytochrome P450 1A2
(Homo sapiens (Human)) | BDBM50348310
(CHEMBL1800911 | US8772288, 1)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)NC1CC1 Show InChI InChI=1S/C23H24N2O2/c1-14-4-5-16(21(26)24-17-7-8-17)12-18(14)15-6-9-19-20(13-15)25-22(27)23(19)10-2-3-11-23/h4-6,9,12-13,17H,2-3,7-8,10-11H2,1H3,(H,24,26)(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of CYP1A2 |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50348310
(CHEMBL1800911 | US8772288, 1)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)NC1CC1 Show InChI InChI=1S/C23H24N2O2/c1-14-4-5-16(21(26)24-17-7-8-17)12-18(14)15-6-9-19-20(13-15)25-22(27)23(19)10-2-3-11-23/h4-6,9,12-13,17H,2-3,7-8,10-11H2,1H3,(H,24,26)(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of CYP2C9 |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50348310
(CHEMBL1800911 | US8772288, 1)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)NC1CC1 Show InChI InChI=1S/C23H24N2O2/c1-14-4-5-16(21(26)24-17-7-8-17)12-18(14)15-6-9-19-20(13-15)25-22(27)23(19)10-2-3-11-23/h4-6,9,12-13,17H,2-3,7-8,10-11H2,1H3,(H,24,26)(H,25,27) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2C19
(Homo sapiens (Human)) | BDBM50348310
(CHEMBL1800911 | US8772288, 1)Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(=O)NC1CC1 Show InChI InChI=1S/C23H24N2O2/c1-14-4-5-16(21(26)24-17-7-8-17)12-18(14)15-6-9-19-20(13-15)25-22(27)23(19)10-2-3-11-23/h4-6,9,12-13,17H,2-3,7-8,10-11H2,1H3,(H,24,26)(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition of CYP2C19 |
Bioorg Med Chem Lett 21: 4130-3 (2011)
Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM |
More data for this
Ligand-Target Pair | |
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