BDBM50247987 9-benzyl-2,3,4,9-tetrahydro-1H-carbazole-8-carboxylic acid::CHEMBL452596

SMILES: OC(=O)c1cccc2c3CCCCc3n(Cc3ccccc3)c12

InChI Key: InChIKey=VDOXYKGIKBUISK-UHFFFAOYSA-N

Data: 2 IC50

PDB links: 1 PDB ID matches this monomer.

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 = 50247987   

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
Fatty acid binding protein muscle (Homo sapiens (Human))	BDBM50247987 (9-benzyl-2,3,4,9-tetrahydro-1H-carbazole-8-carboxy...) Show SMILES OC(=O)c1cccc2c3CCCCc3n(Cc3ccccc3)c12 Show InChI InChI=1S/C20H19NO2/c22-20(23)17-11-6-10-16-15-9-4-5-12-18(15)21(19(16)17)13-14-7-2-1-3-8-14/h1-3,6-8,10-11H,4-5,9,12-13H2,(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar	CHEMBL DrugBank PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	3.88E+3	n/a	n/a	n/a	n/a	n/a	n/a
Biovitrum AB Curated by ChEMBL					Assay Description Inhibition of human H-FABP by fluorescence polarization assay				Bioorg Med Chem Lett 19: 1745-8 (2009) Article DOI: 10.1016/j.bmcl.2009.01.084 BindingDB Entry DOI: 10.7270/Q2TX3F8G
					More data for this Ligand-Target Pair
Fatty acid-binding protein 4 (FABP4) (Homo sapiens (Human))	BDBM50247987 (9-benzyl-2,3,4,9-tetrahydro-1H-carbazole-8-carboxy...) Show SMILES OC(=O)c1cccc2c3CCCCc3n(Cc3ccccc3)c12 Show InChI InChI=1S/C20H19NO2/c22-20(23)17-11-6-10-16-15-9-4-5-12-18(15)21(19(16)17)13-14-7-2-1-3-8-14/h1-3,6-8,10-11H,4-5,9,12-13H2,(H,22,23)	PDB Reactome pathway UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar	CHEMBL DrugBank PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
Biovitrum AB Curated by ChEMBL					Assay Description Inhibition of human A-FABP by fluorescence polarization assay				Bioorg Med Chem Lett 19: 1745-8 (2009) Article DOI: 10.1016/j.bmcl.2009.01.084 BindingDB Entry DOI: 10.7270/Q2TX3F8G
					More data for this Ligand-Target Pair				3D Structure (crystal)