BDBM50218480 4-{5,7,7,10,10-pentamethyl-2-[(E)-(3-phenyl-acryloyl)amino]-7,8,9,10-tetrahydro-5H-5,13-diaza-benzo[4,5]cyclohepta[1,2-b]naphthalen-12-yl}-benzoic acid::CHEMBL396867

SMILES: CN1c2ccc(NC(=O)\C=C\c3ccccc3)cc2N=C(c2ccc(cc2)C(O)=O)c2cc3c(cc12)C(C)(C)CCC3(C)C

InChI Key: InChIKey=AVPVQAULDWVWHT-WOJGMQOQSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50218480   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50218480 (4-{5,7,7,10,10-pentamethyl-2-[(E)-(3-phenyl-acrylo...) Show SMILES CN1c2ccc(NC(=O)\C=C\c3ccccc3)cc2N=C(c2ccc(cc2)C(O)=O)c2cc3c(cc12)C(C)(C)CCC3(C)C |t:21| Show InChI InChI=1S/C38H37N3O3/c1-37(2)19-20-38(3,4)30-23-33-28(22-29(30)37)35(25-12-14-26(15-13-25)36(43)44)40-31-21-27(16-17-32(31)41(33)5)39-34(42)18-11-24-9-7-6-8-10-24/h6-18,21-23H,19-20H2,1-5H3,(H,39,42)(H,43,44)/b18-11+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human RXRalpha expressed in EK293 cells assessed as inhibition of 9-cis-retinoic acid-induced transactivation				Bioorg Med Chem Lett 17: 4808-11 (2007) Article DOI: 10.1016/j.bmcl.2007.06.079 BindingDB Entry DOI: 10.7270/Q2V40TWB
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50218480 (4-{5,7,7,10,10-pentamethyl-2-[(E)-(3-phenyl-acrylo...) Show SMILES CN1c2ccc(NC(=O)\C=C\c3ccccc3)cc2N=C(c2ccc(cc2)C(O)=O)c2cc3c(cc12)C(C)(C)CCC3(C)C |t:21| Show InChI InChI=1S/C38H37N3O3/c1-37(2)19-20-38(3,4)30-23-33-28(22-29(30)37)35(25-12-14-26(15-13-25)36(43)44)40-31-21-27(16-17-32(31)41(33)5)39-34(42)18-11-24-9-7-6-8-10-24/h6-18,21-23H,19-20H2,1-5H3,(H,39,42)(H,43,44)/b18-11+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human RXRalpha expressed in EK293 cells assessed as inhibition of LG100268-induced transactivation				Bioorg Med Chem Lett 17: 4808-11 (2007) Article DOI: 10.1016/j.bmcl.2007.06.079 BindingDB Entry DOI: 10.7270/Q2V40TWB
					More data for this Ligand-Target Pair