BDBM50141589 (Z)-3-[7-(2-Butoxy-3,5-diisopropyl-phenyl)-benzofuran-2-yl]-2-fluoro-but-2-enoic acid::CHEMBL290246

SMILES CCCCOc1c(cc(cc1-c1cccc2cc(oc12)C(\C)=C(/F)C(O)=O)C(C)C)C(C)C

InChI Key InChIKey=AHLAAPXBKCKDHE-BWAHOGKJSA-N

Data  6 KI  1 IC50

Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50141589   

TargetRetinoic acid receptor RXR-alpha(Homo sapiens (Human))
Ligand Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50141589((Z)-3-[7-(2-Butoxy-3,5-diisopropyl-phenyl)-benzofu...)
Show SMILES CCCCOc1c(cc(cc1-c1cccc2cc(oc12)C(\C)=C(/F)C(O)=O)C(C)C)C(C)C
Show InChI InChI=1S/C28H33FO4/c1-7-8-12-32-27-22(17(4)5)13-20(16(2)3)14-23(27)21-11-9-10-19-15-24(33-26(19)21)18(6)25(29)28(30)31/h9-11,13-17H,7-8,12H2,1-6H3,(H,30,31)/b25-18-
Affinity DataKi:  16nMAssay Description:Binding affinity against Retinoic acid receptor RXR-alpha by [3H]-9-cis-RA displacement.More data for this Ligand-Target Pair
TargetRetinoic acid receptor RXR-gamma(Homo sapiens (Human))
Ligand Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50141589((Z)-3-[7-(2-Butoxy-3,5-diisopropyl-phenyl)-benzofu...)
Show SMILES CCCCOc1c(cc(cc1-c1cccc2cc(oc12)C(\C)=C(/F)C(O)=O)C(C)C)C(C)C
Show InChI InChI=1S/C28H33FO4/c1-7-8-12-32-27-22(17(4)5)13-20(16(2)3)14-23(27)21-11-9-10-19-15-24(33-26(19)21)18(6)25(29)28(30)31/h9-11,13-17H,7-8,12H2,1-6H3,(H,30,31)/b25-18-
Affinity DataKi:  28nMAssay Description:Displacement of [3H]-9-cis-RA from retinoic X receptor gammaMore data for this Ligand-Target Pair
TargetRetinoic acid receptor RXR-beta(Homo sapiens (Human))
Ligand Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50141589((Z)-3-[7-(2-Butoxy-3,5-diisopropyl-phenyl)-benzofu...)
Show SMILES CCCCOc1c(cc(cc1-c1cccc2cc(oc12)C(\C)=C(/F)C(O)=O)C(C)C)C(C)C
Show InChI InChI=1S/C28H33FO4/c1-7-8-12-32-27-22(17(4)5)13-20(16(2)3)14-23(27)21-11-9-10-19-15-24(33-26(19)21)18(6)25(29)28(30)31/h9-11,13-17H,7-8,12H2,1-6H3,(H,30,31)/b25-18-
Affinity DataKi:  65nMAssay Description:Displacement of [3H]-9-cis-RA from Retinoic X receptor betaMore data for this Ligand-Target Pair
TargetRetinoic acid receptor RXR-gamma(Mus musculus)
Ligand Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50141589((Z)-3-[7-(2-Butoxy-3,5-diisopropyl-phenyl)-benzofu...)
Show SMILES CCCCOc1c(cc(cc1-c1cccc2cc(oc12)C(\C)=C(/F)C(O)=O)C(C)C)C(C)C
Show InChI InChI=1S/C28H33FO4/c1-7-8-12-32-27-22(17(4)5)13-20(16(2)3)14-23(27)21-11-9-10-19-15-24(33-26(19)21)18(6)25(29)28(30)31/h9-11,13-17H,7-8,12H2,1-6H3,(H,30,31)/b25-18-
Affinity DataKi: >1.00E+4nMAssay Description:Binding affinity against retinoic acid receptor gamma by [3H]-ATRA displacement.More data for this Ligand-Target Pair
TargetRetinoic acid receptor RXR-beta(Mus musculus)
Ligand Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50141589((Z)-3-[7-(2-Butoxy-3,5-diisopropyl-phenyl)-benzofu...)
Show SMILES CCCCOc1c(cc(cc1-c1cccc2cc(oc12)C(\C)=C(/F)C(O)=O)C(C)C)C(C)C
Show InChI InChI=1S/C28H33FO4/c1-7-8-12-32-27-22(17(4)5)13-20(16(2)3)14-23(27)21-11-9-10-19-15-24(33-26(19)21)18(6)25(29)28(30)31/h9-11,13-17H,7-8,12H2,1-6H3,(H,30,31)/b25-18-
Affinity DataKi: >1.00E+4nMAssay Description:Binding affinity again retinoic acid receptor beta by [3H]-ATRA displacement.More data for this Ligand-Target Pair
TargetRetinoic acid receptor alpha(Homo sapiens (Human))
Ligand Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50141589((Z)-3-[7-(2-Butoxy-3,5-diisopropyl-phenyl)-benzofu...)
Show SMILES CCCCOc1c(cc(cc1-c1cccc2cc(oc12)C(\C)=C(/F)C(O)=O)C(C)C)C(C)C
Show InChI InChI=1S/C28H33FO4/c1-7-8-12-32-27-22(17(4)5)13-20(16(2)3)14-23(27)21-11-9-10-19-15-24(33-26(19)21)18(6)25(29)28(30)31/h9-11,13-17H,7-8,12H2,1-6H3,(H,30,31)/b25-18-
Affinity DataKi: >1.00E+4nMAssay Description:Binding affinity against retinoic acid receptor alpha by [3H]-ATRA displacement.More data for this Ligand-Target Pair
TargetRetinoic acid receptor RXR-alpha(Homo sapiens (Human))
Ligand Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50141589((Z)-3-[7-(2-Butoxy-3,5-diisopropyl-phenyl)-benzofu...)
Show SMILES CCCCOc1c(cc(cc1-c1cccc2cc(oc12)C(\C)=C(/F)C(O)=O)C(C)C)C(C)C
Show InChI InChI=1S/C28H33FO4/c1-7-8-12-32-27-22(17(4)5)13-20(16(2)3)14-23(27)21-11-9-10-19-15-24(33-26(19)21)18(6)25(29)28(30)31/h9-11,13-17H,7-8,12H2,1-6H3,(H,30,31)/b25-18-
Affinity DataIC50: 11nMAssay Description:Binding affinity against Retinoic acid receptor RXR-alpha by [3H]-9-cis-RA displacement.More data for this Ligand-Target Pair