BindingDB logo
myBDB logout

PubMed code 8691435

Compile data set for download or QSAR
Found 33 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM31885
PNG
(BMS184394 | CHEMBL82089)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(O)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem

Patents

Similars
Article
PubMed
n/an/an/a 7.50E+3n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM31882
PNG
(BMS184394-R | CHEMBL80992)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)[C@H](O)c1ccc2cc(ccc2c1)C(O)=O |r|
Show InChI InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)/t23-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 816n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM31882
PNG
(BMS184394-R | CHEMBL80992)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)[C@H](O)c1ccc2cc(ccc2c1)C(O)=O |r|
Show InChI InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)/t23-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 4.10E+3n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM50051552
PNG
(6-[HYDROXYIMINO-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRA...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(N=O)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H27NO3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27-30)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23H,11-12H2,1-4H3,(H,28,29)
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/an/an/a 700n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM50051555
PNG
(6-[methyl sulphonylHydrazono-(5,5,8,8-tetramethyl-...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(=N\NS(C)(=O)=O)\c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C27H30N2O4S/c1-26(2)12-13-27(3,4)23-16-20(10-11-22(23)26)24(28-29-34(5,32)33)19-8-6-18-15-21(25(30)31)9-7-17(18)14-19/h6-11,14-16,29H,12-13H2,1-5H3,(H,30,31)/b28-24+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 1.28E+3n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM31882
PNG
(BMS184394-R | CHEMBL80992)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)[C@H](O)c1ccc2cc(ccc2c1)C(O)=O |r|
Show InChI InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)/t23-/m1/s1
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/an/an/a 7.50E+3n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM50051555
PNG
(6-[methyl sulphonylHydrazono-(5,5,8,8-tetramethyl-...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(=N\NS(C)(=O)=O)\c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C27H30N2O4S/c1-26(2)12-13-27(3,4)23-16-20(10-11-22(23)26)24(28-29-34(5,32)33)19-8-6-18-15-21(25(30)31)9-7-17(18)14-19/h6-11,14-16,29H,12-13H2,1-5H3,(H,30,31)/b28-24+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 1.10E+4n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM50051551
PNG
(6-[Hydrazono-(5,5,8,8-tetramethyl-5,6,7,8-tetrahyd...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(N=N)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H28N2O2/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(28-27)18-7-5-17-14-20(24(29)30)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,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/an/an/a 2.20E+3n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM50051551
PNG
(6-[Hydrazono-(5,5,8,8-tetramethyl-5,6,7,8-tetrahyd...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(N=N)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H28N2O2/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(28-27)18-7-5-17-14-20(24(29)30)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,29,30)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 43n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM50051555
PNG
(6-[methyl sulphonylHydrazono-(5,5,8,8-tetramethyl-...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(=N\NS(C)(=O)=O)\c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C27H30N2O4S/c1-26(2)12-13-27(3,4)23-16-20(10-11-22(23)26)24(28-29-34(5,32)33)19-8-6-18-15-21(25(30)31)9-7-17(18)14-19/h6-11,14-16,29H,12-13H2,1-5H3,(H,30,31)/b28-24+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 4.38E+3n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM50051553
PNG
(6-[1-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-napht...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(=C)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C27H28O2/c1-17(18-6-7-21-15-22(25(28)29)9-8-20(21)14-18)19-10-11-23-24(16-19)27(4,5)13-12-26(23,2)3/h6-11,14-16H,1,12-13H2,2-5H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/an/a 1.10n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM31885
PNG
(BMS184394 | CHEMBL82089)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(O)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem

Patents

Similars
PDB
Article
PubMed
n/an/an/a 64n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM50051554
PNG
(6-[2,2-Difluoro-1-(5,5,8,8-tetramethyl-5,6,7,8-tet...)
Show SMILES [#6]C1([#6])[#6]-[#6]C([#6])([#6])c2cc(ccc12)-[#6](=[#6](\F)F)\c1ccc2cc(ccc2c1)-[#6](-[#8])=O
Show InChI InChI=1S/C27H26F2O2/c1-26(2)11-12-27(3,4)22-15-19(9-10-21(22)26)23(24(28)29)18-7-5-17-14-20(25(30)31)8-6-16(17)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,30,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 7.5n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM31883
PNG
(9-cis-retinoic acid (9cRA) | ALL-TRANS-RETINOIC AC...)
Show SMILES C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O |c:4|
Show InChI InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
UniChem

Patents

Similars
MMDB
Article
PubMed
n/an/an/a 0.400n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM50051551
PNG
(6-[Hydrazono-(5,5,8,8-tetramethyl-5,6,7,8-tetrahyd...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(N=N)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H28N2O2/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(28-27)18-7-5-17-14-20(24(29)30)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,29,30)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 95n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM31884
PNG
(BMS184394-S | CHEMBL81273)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)[C@@H](O)c1ccc2cc(ccc2c1)C(O)=O |r|
Show InChI InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)/t23-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars
MMDB
PDB
Article
PubMed
n/an/an/a 75n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM50051552
PNG
(6-[HYDROXYIMINO-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRA...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(N=O)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H27NO3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27-30)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23H,11-12H2,1-4H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 50n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM50051554
PNG
(6-[2,2-Difluoro-1-(5,5,8,8-tetramethyl-5,6,7,8-tet...)
Show SMILES [#6]C1([#6])[#6]-[#6]C([#6])([#6])c2cc(ccc12)-[#6](=[#6](\F)F)\c1ccc2cc(ccc2c1)-[#6](-[#8])=O
Show InChI InChI=1S/C27H26F2O2/c1-26(2)11-12-27(3,4)22-15-19(9-10-21(22)26)23(24(28)29)18-7-5-17-14-20(25(30)31)8-6-16(17)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,30,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 1.70n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM50051552
PNG
(6-[HYDROXYIMINO-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRA...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(N=O)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H27NO3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27-30)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23H,11-12H2,1-4H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 3.30n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM31883
PNG
(9-cis-retinoic acid (9cRA) | ALL-TRANS-RETINOIC AC...)
Show SMILES C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O |c:4|
Show InChI InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/an/a 2.30n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM50051556
PNG
(6-[Methoxy-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro...)
Show SMILES COC(c1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C27H30O3/c1-26(2)12-13-27(3,4)23-16-20(10-11-22(23)26)24(30-5)19-8-6-18-15-21(25(28)29)9-7-17(18)14-19/h6-11,14-16,24H,12-13H2,1-5H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 400n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM31883
PNG
(9-cis-retinoic acid (9cRA) | ALL-TRANS-RETINOIC AC...)
Show SMILES C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O |c:4|
Show InChI InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
UniChem

Patents

Similars
MMDB
Article
PubMed
n/an/an/a 0.300n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM31886
PNG
(CD564 | CHEMBL309282)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(=O)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H26O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
MMDB
PDB
Article
PubMed
n/an/an/a 3n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM31886
PNG
(CD564 | CHEMBL309282)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(=O)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H26O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
MMDB
PDB
Article
PubMed
n/an/an/a 1.20n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM31884
PNG
(BMS184394-S | CHEMBL81273)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)[C@@H](O)c1ccc2cc(ccc2c1)C(O)=O |r|
Show InChI InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)/t23-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars
MMDB
PDB
Article
PubMed
n/an/an/a 531n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM50051556
PNG
(6-[Methoxy-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro...)
Show SMILES COC(c1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C27H30O3/c1-26(2)12-13-27(3,4)23-16-20(10-11-22(23)26)24(30-5)19-8-6-18-15-21(25(28)29)9-7-17(18)14-19/h6-11,14-16,24H,12-13H2,1-5H3,(H,28,29)
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/an/an/a 6.50E+3n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM31886
PNG
(CD564 | CHEMBL309282)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(=O)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H26O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,28,29)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
Article
PubMed
n/an/an/a 118n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM50051553
PNG
(6-[1-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-napht...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(=C)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C27H28O2/c1-17(18-6-7-21-15-22(25(28)29)9-8-20(21)14-18)19-10-11-23-24(16-19)27(4,5)13-12-26(23,2)3/h6-11,14-16H,1,12-13H2,2-5H3,(H,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/an/an/a 68n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM50051556
PNG
(6-[Methoxy-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro...)
Show SMILES COC(c1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C27H30O3/c1-26(2)12-13-27(3,4)23-16-20(10-11-22(23)26)24(30-5)19-8-6-18-15-21(25(28)29)9-7-17(18)14-19/h6-11,14-16,24H,12-13H2,1-5H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 250n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor beta


(Homo sapiens (Human))		BDBM31885
PNG
(BMS184394 | CHEMBL82089)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(O)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem

Patents

Similars
PDB
Article
PubMed
n/an/an/a 679n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant for Retinoic acid receptor beta in HeLa cellGAL-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM31884
PNG
(BMS184394-S | CHEMBL81273)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)[C@@H](O)c1ccc2cc(ccc2c1)C(O)=O |r|
Show InChI InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)/t23-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars
Article
PubMed
n/an/an/a 1.65E+4n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))		BDBM50051553
PNG
(6-[1-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-napht...)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C(=C)c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C27H28O2/c1-17(18-6-7-21-15-22(25(28)29)9-8-20(21)14-18)19-10-11-23-24(16-19)27(4,5)13-12-26(23,2)3/h6-11,14-16H,1,12-13H2,2-5H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/an/a 1.30n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor gamma in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Homo sapiens (Human))		BDBM50051554
PNG
(6-[2,2-Difluoro-1-(5,5,8,8-tetramethyl-5,6,7,8-tet...)
Show SMILES [#6]C1([#6])[#6]-[#6]C([#6])([#6])c2cc(ccc12)-[#6](=[#6](\F)F)\c1ccc2cc(ccc2c1)-[#6](-[#8])=O
Show InChI InChI=1S/C27H26F2O2/c1-26(2)11-12-27(3,4)22-15-19(9-10-21(22)26)23(24(28)29)18-7-5-17-14-20(25(30)31)8-6-16(17)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,30,31)
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/an/an/a 73n/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Apparent binding constant against Retinoic acid receptor alpha in HeLa cell GAl-4 transactivation assay

J Med Chem 39: 2411-21 (1996)


Article DOI: 10.1021/jm9502293
BindingDB Entry DOI: 10.7270/Q2MS3RVK
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%