Found 37 hits Enz. Inhib. hit(s) with all data for entry = 50013082 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 |
|---|
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM16181
(1-[2-(4-cyanophenyl)-2-hydroxy-2-(1-methyl-1H-imid...)Show SMILES Cn1cncc1C(O)(CN1CCC(C#N)=C(C1)c1cccc2ccccc12)c1ccc(cc1)C#N |c:15| Show InChI InChI=1S/C29H25N5O/c1-33-20-32-17-28(33)29(35,24-11-9-21(15-30)10-12-24)19-34-14-13-23(16-31)27(18-34)26-8-4-6-22-5-2-3-7-25(22)26/h2-12,17,20,35H,13-14,18-19H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 0.480 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126326
(1-[(4-Cyano-phenyl)-(3-methyl-3H-imidazol-4-yl)-me...)Show SMILES Cn1cncc1C(N1CCC(C#N)=C(C1)c1cccc2ccccc12)c1ccc(cc1)C#N |c:13| Show InChI InChI=1S/C28H23N5/c1-32-19-31-17-27(32)28(22-11-9-20(15-29)10-12-22)33-14-13-23(16-30)26(18-33)25-8-4-6-21-5-2-3-7-24(21)25/h2-12,17,19,28H,13-14,18H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126320
(1-{[(4-Cyano-phenyl)-(3-methyl-3H-imidazol-4-yl)-m...)Show SMILES Cn1cncc1C(NN1CCC(C#N)=C(C1)c1cccc2ccccc12)c1ccc(cc1)C#N |c:14| Show InChI InChI=1S/C28H24N6/c1-33-19-31-17-27(33)28(22-11-9-20(15-29)10-12-22)32-34-14-13-23(16-30)26(18-34)25-8-4-6-21-5-2-3-7-24(21)25/h2-12,17,19,28,32H,13-14,18H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM17335
(1-[(2R)-2-{[(4-cyanophenyl)methyl](methyl)amino}-3...)Show SMILES CN(Cc1ccc(cc1)C#N)[C@H](Cc1cncn1C)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |r,c:28| Show InChI InChI=1S/C32H30N6O/c1-36(20-24-12-10-23(17-33)11-13-24)31(16-27-19-35-22-37(27)2)32(39)38-15-14-26(18-34)30(21-38)29-9-5-7-25-6-3-4-8-28(25)29/h3-13,19,22,31H,14-16,20-21H2,1-2H3/t31-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.920 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126323
(1-{3-[3-(4-Cyano-benzyl)-3H-imidazol-4-yl]-propion...)Show SMILES O=C(CCc1cncn1Cc1ccc(cc1)C#N)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:25| Show InChI InChI=1S/C30H25N5O/c31-16-22-8-10-23(11-9-22)19-35-21-33-18-26(35)12-13-30(36)34-15-14-25(17-32)29(20-34)28-7-3-5-24-4-1-2-6-27(24)28/h1-11,18,21H,12-15,19-20H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126324
(1-{2-[3-(4-Cyano-3-naphthalen-1-yl-benzyl)-3H-imid...)Show SMILES COC1=C(CCN(C1)C(=O)Cc1cncn1Cc1ccc(C#N)c(c1)-c1cccc2ccccc12)C#N |t:2| Show InChI InChI=1S/C30H25N5O2/c1-37-29-19-34(12-11-24(29)16-32)30(36)14-25-17-33-20-35(25)18-21-9-10-23(15-31)28(13-21)27-8-4-6-22-5-2-3-7-26(22)27/h2-10,13,17,20H,11-12,14,18-19H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126317
(1-{2-[3-(4-Cyano-benzyl)-3H-imidazol-4-yl]-acetyl}...)Show SMILES O=C(Cc1cncn1Cc1ccc(cc1)C#N)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:24| Show InChI InChI=1S/C29H23N5O/c30-15-21-8-10-22(11-9-21)18-34-20-32-17-25(34)14-29(35)33-13-12-24(16-31)28(19-33)27-7-3-5-23-4-1-2-6-26(23)27/h1-11,17,20H,12-14,18-19H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Similars
| PDB
PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126322
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1ccc(C#N)c(Br)c1)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:27| Show InChI InChI=1S/C30H25BrN6O/c1-35-20-34-16-25(35)18-37(17-21-9-10-24(15-33)29(31)13-21)30(38)36-12-11-23(14-32)28(19-36)27-8-4-6-22-5-2-3-7-26(22)27/h2-10,13,16,20H,11-12,17-19H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126325
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1ccc(cc1)C#N)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:26| Show InChI InChI=1S/C30H26N6O/c1-34-21-33-17-26(34)19-36(18-23-11-9-22(15-31)10-12-23)30(37)35-14-13-25(16-32)29(20-35)28-8-4-6-24-5-2-3-7-27(24)28/h2-12,17,21H,13-14,18-20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126327
(1-{2-[3-(3-Chloro-4-cyano-benzyl)-3H-imidazol-4-yl...)Show SMILES Clc1cc(Cn2cncc2CC(=O)N2CCC(C#N)=C(C2)c2cccc3ccccc23)ccc1C#N |c:19| Show InChI InChI=1S/C29H22ClN5O/c30-28-12-20(8-9-23(28)15-32)17-35-19-33-16-24(35)13-29(36)34-11-10-22(14-31)27(18-34)26-7-3-5-21-4-1-2-6-25(21)26/h1-9,12,16,19H,10-11,13,17-18H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126319
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1ccc(Cl)c(Cl)c1)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:26| Show InChI InChI=1S/C29H25Cl2N5O/c1-34-19-33-15-23(34)17-36(16-20-9-10-27(30)28(31)13-20)29(37)35-12-11-22(14-32)26(18-35)25-8-4-6-21-5-2-3-7-24(21)25/h2-10,13,15,19H,11-12,16-18H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126318
(1-{2-[3-(4-Chloro-benzyl)-3H-imidazol-4-yl]-acetyl...)Show SMILES Clc1ccc(Cn2cncc2CC(=O)N2CCC(C#N)=C(C2)c2cccc3ccccc23)cc1 |c:20| Show InChI InChI=1S/C28H23ClN4O/c29-23-10-8-20(9-11-23)17-33-19-31-16-24(33)14-28(34)32-13-12-22(15-30)27(18-32)26-7-3-5-21-4-1-2-6-25(21)26/h1-11,16,19H,12-14,17-18H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126321
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1cccc(c1)C#N)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:26| Show InChI InChI=1S/C30H26N6O/c1-34-21-33-17-26(34)19-36(18-23-7-4-6-22(14-23)15-31)30(37)35-13-12-25(16-32)29(20-35)28-11-5-9-24-8-2-3-10-27(24)28/h2-11,14,17,21H,12-13,18-20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 59 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of farnesyltransferase |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM16181
(1-[2-(4-cyanophenyl)-2-hydroxy-2-(1-methyl-1H-imid...)Show SMILES Cn1cncc1C(O)(CN1CCC(C#N)=C(C1)c1cccc2ccccc12)c1ccc(cc1)C#N |c:15| Show InChI InChI=1S/C29H25N5O/c1-33-20-32-17-28(33)29(35,24-11-9-21(15-30)10-12-24)19-34-14-13-23(16-31)27(18-34)26-8-4-6-22-5-2-3-7-25(22)26/h2-12,17,20,35H,13-14,18-19H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 540 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126320
(1-{[(4-Cyano-phenyl)-(3-methyl-3H-imidazol-4-yl)-m...)Show SMILES Cn1cncc1C(NN1CCC(C#N)=C(C1)c1cccc2ccccc12)c1ccc(cc1)C#N |c:14| Show InChI InChI=1S/C28H24N6/c1-33-19-31-17-27(33)28(22-11-9-20(15-29)10-12-22)32-34-14-13-23(16-30)26(18-34)25-8-4-6-21-5-2-3-7-24(21)25/h2-12,17,19,28,32H,13-14,18H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126327
(1-{2-[3-(3-Chloro-4-cyano-benzyl)-3H-imidazol-4-yl...)Show SMILES Clc1cc(Cn2cncc2CC(=O)N2CCC(C#N)=C(C2)c2cccc3ccccc23)ccc1C#N |c:19| Show InChI InChI=1S/C29H22ClN5O/c30-28-12-20(8-9-23(28)15-32)17-35-19-33-16-24(35)13-29(36)34-11-10-22(14-31)27(18-34)26-7-3-5-21-4-1-2-6-25(21)26/h1-9,12,16,19H,10-11,13,17-18H2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126323
(1-{3-[3-(4-Cyano-benzyl)-3H-imidazol-4-yl]-propion...)Show SMILES O=C(CCc1cncn1Cc1ccc(cc1)C#N)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:25| Show InChI InChI=1S/C30H25N5O/c31-16-22-8-10-23(11-9-22)19-35-21-33-18-26(35)12-13-30(36)34-15-14-25(17-32)29(20-34)28-7-3-5-24-4-1-2-6-27(24)28/h1-11,18,21H,12-15,19-20H2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126322
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1ccc(C#N)c(Br)c1)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:27| Show InChI InChI=1S/C30H25BrN6O/c1-35-20-34-16-25(35)18-37(17-21-9-10-24(15-33)29(31)13-21)30(38)36-12-11-23(14-32)28(19-36)27-8-4-6-22-5-2-3-7-26(22)27/h2-10,13,16,20H,11-12,17-19H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
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PC sid
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| n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126319
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1ccc(Cl)c(Cl)c1)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:26| Show InChI InChI=1S/C29H25Cl2N5O/c1-34-19-33-15-23(34)17-36(16-20-9-10-27(30)28(31)13-20)29(37)35-12-11-22(14-32)26(18-35)25-8-4-6-21-5-2-3-7-24(21)25/h2-10,13,15,19H,11-12,16-18H2,1H3 | PDB
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| n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM17335
(1-[(2R)-2-{[(4-cyanophenyl)methyl](methyl)amino}-3...)Show SMILES CN(Cc1ccc(cc1)C#N)[C@H](Cc1cncn1C)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |r,c:28| Show InChI InChI=1S/C32H30N6O/c1-36(20-24-12-10-23(17-33)11-13-24)31(16-27-19-35-22-37(27)2)32(39)38-15-14-26(18-34)30(21-38)29-9-5-7-25-6-3-4-8-28(25)29/h3-13,19,22,31H,14-16,20-21H2,1-2H3/t31-/m1/s1 | PDB
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| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126324
(1-{2-[3-(4-Cyano-3-naphthalen-1-yl-benzyl)-3H-imid...)Show SMILES COC1=C(CCN(C1)C(=O)Cc1cncn1Cc1ccc(C#N)c(c1)-c1cccc2ccccc12)C#N |t:2| Show InChI InChI=1S/C30H25N5O2/c1-37-29-19-34(12-11-24(29)16-32)30(36)14-25-17-33-20-35(25)18-21-9-10-23(15-31)28(13-21)27-8-4-6-22-5-2-3-7-26(22)27/h2-10,13,17,20H,11-12,14,18-19H2,1H3 | PDB
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| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126325
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1ccc(cc1)C#N)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:26| Show InChI InChI=1S/C30H26N6O/c1-34-21-33-17-26(34)19-36(18-23-11-9-22(15-31)10-12-23)30(37)35-14-13-25(16-32)29(20-35)28-8-4-6-24-5-2-3-7-27(24)28/h2-12,17,21H,13-14,18-20H2,1H3 | PDB
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| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126317
(1-{2-[3-(4-Cyano-benzyl)-3H-imidazol-4-yl]-acetyl}...)Show SMILES O=C(Cc1cncn1Cc1ccc(cc1)C#N)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:24| Show InChI InChI=1S/C29H23N5O/c30-15-21-8-10-22(11-9-21)18-34-20-32-17-25(34)14-29(35)33-13-12-24(16-31)28(19-33)27-7-3-5-23-4-1-2-6-26(23)27/h1-11,17,20H,12-14,18-19H2 | PDB
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PubMed
| n/a | n/a | 4.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126318
(1-{2-[3-(4-Chloro-benzyl)-3H-imidazol-4-yl]-acetyl...)Show SMILES Clc1ccc(Cn2cncc2CC(=O)N2CCC(C#N)=C(C2)c2cccc3ccccc23)cc1 |c:20| Show InChI InChI=1S/C28H23ClN4O/c29-23-10-8-20(9-11-23)17-33-19-31-16-24(33)14-28(34)32-13-12-22(15-30)27(18-32)26-7-3-5-21-4-1-2-6-25(21)26/h1-11,16,19H,12-14,17-18H2 | PDB
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126321
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1cccc(c1)C#N)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:26| Show InChI InChI=1S/C30H26N6O/c1-34-21-33-17-26(34)19-36(18-23-7-4-6-22(14-23)15-31)30(37)35-13-12-25(16-32)29(20-35)28-11-5-9-24-8-2-3-10-27(24)28/h2-11,14,17,21H,12-13,18-20H2,1H3 | PDB
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| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50126326
(1-[(4-Cyano-phenyl)-(3-methyl-3H-imidazol-4-yl)-me...)Show SMILES Cn1cncc1C(N1CCC(C#N)=C(C1)c1cccc2ccccc12)c1ccc(cc1)C#N |c:13| Show InChI InChI=1S/C28H23N5/c1-32-19-31-17-27(32)28(22-11-9-20(15-29)10-12-22)33-14-13-23(16-30)26(18-33)25-8-4-6-21-5-2-3-7-24(21)25/h2-12,17,19,28H,13-14,18H2,1H3 | PDB
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| n/a | n/a | 1.61E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM50126325
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1ccc(cc1)C#N)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:26| Show InChI InChI=1S/C30H26N6O/c1-34-21-33-17-26(34)19-36(18-23-11-9-22(15-31)10-12-23)30(37)35-14-13-25(16-32)29(20-35)28-8-4-6-24-5-2-3-7-27(24)28/h2-12,17,21H,13-14,18-20H2,1H3 | PDB
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| n/a | n/a | n/a | n/a | 97 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM50126322
(4-Cyano-5-naphthalen-1-yl-3,6-dihydro-2H-pyridine-...)Show SMILES Cn1cncc1CN(Cc1ccc(C#N)c(Br)c1)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:27| Show InChI InChI=1S/C30H25BrN6O/c1-35-20-34-16-25(35)18-37(17-21-9-10-24(15-33)29(31)13-21)30(38)36-12-11-23(14-32)28(19-36)27-8-4-6-22-5-2-3-7-26(22)27/h2-10,13,16,20H,11-12,17-19H2,1H3 | PDB
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| n/a | n/a | n/a | n/a | >1 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM50126317
(1-{2-[3-(4-Cyano-benzyl)-3H-imidazol-4-yl]-acetyl}...)Show SMILES O=C(Cc1cncn1Cc1ccc(cc1)C#N)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:24| Show InChI InChI=1S/C29H23N5O/c30-15-21-8-10-22(11-9-21)18-34-20-32-17-25(34)14-29(35)33-13-12-24(16-31)28(19-33)27-7-3-5-23-4-1-2-6-26(23)27/h1-11,17,20H,12-14,18-19H2 | PDB
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| n/a | n/a | n/a | n/a | 3.90 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM50126326
(1-[(4-Cyano-phenyl)-(3-methyl-3H-imidazol-4-yl)-me...)Show SMILES Cn1cncc1C(N1CCC(C#N)=C(C1)c1cccc2ccccc12)c1ccc(cc1)C#N |c:13| Show InChI InChI=1S/C28H23N5/c1-32-19-31-17-27(32)28(22-11-9-20(15-29)10-12-22)33-14-13-23(16-30)26(18-33)25-8-4-6-21-5-2-3-7-24(21)25/h2-12,17,19,28H,13-14,18H2,1H3 | PDB
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| n/a | n/a | n/a | n/a | 31 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM50126318
(1-{2-[3-(4-Chloro-benzyl)-3H-imidazol-4-yl]-acetyl...)Show SMILES Clc1ccc(Cn2cncc2CC(=O)N2CCC(C#N)=C(C2)c2cccc3ccccc23)cc1 |c:20| Show InChI InChI=1S/C28H23ClN4O/c29-23-10-8-20(9-11-23)17-33-19-31-16-24(33)14-28(34)32-13-12-22(15-30)27(18-32)26-7-3-5-21-4-1-2-6-25(21)26/h1-11,16,19H,12-14,17-18H2 | PDB
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| n/a | n/a | n/a | n/a | >100 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM50126327
(1-{2-[3-(3-Chloro-4-cyano-benzyl)-3H-imidazol-4-yl...)Show SMILES Clc1cc(Cn2cncc2CC(=O)N2CCC(C#N)=C(C2)c2cccc3ccccc23)ccc1C#N |c:19| Show InChI InChI=1S/C29H22ClN5O/c30-28-12-20(8-9-23(28)15-32)17-35-19-33-16-24(35)13-29(36)34-11-10-22(14-31)27(18-34)26-7-3-5-21-4-1-2-6-25(21)26/h1-9,12,16,19H,10-11,13,17-18H2 | PDB
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| n/a | n/a | n/a | n/a | >100 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM17335
(1-[(2R)-2-{[(4-cyanophenyl)methyl](methyl)amino}-3...)Show SMILES CN(Cc1ccc(cc1)C#N)[C@H](Cc1cncn1C)C(=O)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |r,c:28| Show InChI InChI=1S/C32H30N6O/c1-36(20-24-12-10-23(17-33)11-13-24)31(16-27-19-35-22-37(27)2)32(39)38-15-14-26(18-34)30(21-38)29-9-5-7-25-6-3-4-8-28(25)29/h3-13,19,22,31H,14-16,20-21H2,1-2H3/t31-/m1/s1 | PDB
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Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM50126320
(1-{[(4-Cyano-phenyl)-(3-methyl-3H-imidazol-4-yl)-m...)Show SMILES Cn1cncc1C(NN1CCC(C#N)=C(C1)c1cccc2ccccc12)c1ccc(cc1)C#N |c:14| Show InChI InChI=1S/C28H24N6/c1-33-19-31-17-27(33)28(22-11-9-20(15-29)10-12-22)32-34-14-13-23(16-30)26(18-34)25-8-4-6-21-5-2-3-7-24(21)25/h2-12,17,19,28,32H,13-14,18H2,1H3 | PDB
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| n/a | n/a | n/a | n/a | 0.5 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM50126323
(1-{3-[3-(4-Cyano-benzyl)-3H-imidazol-4-yl]-propion...)Show SMILES O=C(CCc1cncn1Cc1ccc(cc1)C#N)N1CCC(C#N)=C(C1)c1cccc2ccccc12 |c:25| Show InChI InChI=1S/C30H25N5O/c31-16-22-8-10-23(11-9-22)19-35-21-33-18-26(35)12-13-30(36)34-15-14-25(17-32)29(20-34)28-7-3-5-24-4-1-2-6-27(24)28/h1-11,18,21H,12-15,19-20H2 | PDB
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Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM16181
(1-[2-(4-cyanophenyl)-2-hydroxy-2-(1-methyl-1H-imid...)Show SMILES Cn1cncc1C(O)(CN1CCC(C#N)=C(C1)c1cccc2ccccc12)c1ccc(cc1)C#N |c:15| Show InChI InChI=1S/C29H25N5O/c1-33-20-32-17-28(33)29(35,24-11-9-21(15-30)10-12-24)19-34-14-13-23(16-31)27(18-34)26-8-4-6-22-5-2-3-7-25(22)26/h2-12,17,20,35H,13-14,18-19H2,1H3 | PDB
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UniChem
| PubMed
| n/a | n/a | n/a | n/a | 4 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Ras farnesylation in Human Ha-Ras oncogene-transformed BALB/c 3T3 cells (EJ3 cells) |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Mus musculus) | BDBM50126324
(1-{2-[3-(4-Cyano-3-naphthalen-1-yl-benzyl)-3H-imid...)Show SMILES COC1=C(CCN(C1)C(=O)Cc1cncn1Cc1ccc(C#N)c(c1)-c1cccc2ccccc12)C#N |t:2| Show InChI InChI=1S/C30H25N5O2/c1-37-29-19-34(12-11-24(29)16-32)30(36)14-25-17-33-20-35(25)18-21-9-10-23(15-31)28(13-21)27-8-4-6-22-5-2-3-7-26(22)27/h2-10,13,17,20H,11-12,14,18-19H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | n/a | n/a | >100 | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
In vitro inhibition of geranylgeranyltransferase-1 |
Bioorg Med Chem Lett 13: 1363-6 (2003)
BindingDB Entry DOI: 10.7270/Q24B30PD |
More data for this
Ligand-Target Pair | |
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