BDBM50038592 (3-{Hydroxy-[4-(3-methyl-2-pyridin-3-yl-indol-1-yl)-butyl]-phosphinoyloxy}-2-oxo-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl)-acetic acid::CHEMBL54520

SMILES: Cc1c(-c2cccnc2)n(CCCCP(O)(=O)OC2CCc3ccccc3N(CC(O)=O)C2=O)c2ccccc12

InChI Key: InChIKey=SZSBKICHQOPSHU-UHFFFAOYSA-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 = 50038592   

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
Thromboxane A2 Synthase (P450 TxA2) (Homo sapiens (Human))	BDBM50038592 ((3-{Hydroxy-[4-(3-methyl-2-pyridin-3-yl-indol-1-yl...) Show SMILES Cc1c(-c2cccnc2)n(CCCCP(O)(=O)OC2CCc3ccccc3N(CC(O)=O)C2=O)c2ccccc12 Show InChI InChI=1S/C30H32N3O6P/c1-21-24-11-3-5-13-26(24)32(29(21)23-10-8-16-31-19-23)17-6-7-18-40(37,38)39-27-15-14-22-9-2-4-12-25(22)33(30(27)36)20-28(34)35/h2-5,8-13,16,19,27H,6-7,14-15,17-18,20H2,1H3,(H,34,35)(H,37,38)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
CIBA-GEIGY Corporation Curated by ChEMBL					Assay Description Tested for 50% inhibition of thromboxane synthase (TxS) in human platelets (in vitro)				J Med Chem 37: 1823-32 (1994) BindingDB Entry DOI: 10.7270/Q280537C
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Oryctolagus cuniculus)	BDBM50038592 ((3-{Hydroxy-[4-(3-methyl-2-pyridin-3-yl-indol-1-yl...) Show SMILES Cc1c(-c2cccnc2)n(CCCCP(O)(=O)OC2CCc3ccccc3N(CC(O)=O)C2=O)c2ccccc12 Show InChI InChI=1S/C30H32N3O6P/c1-21-24-11-3-5-13-26(24)32(29(21)23-10-8-16-31-19-23)17-6-7-18-40(37,38)39-27-15-14-22-9-2-4-12-25(22)33(30(27)36)20-28(34)35/h2-5,8-13,16,19,27H,6-7,14-15,17-18,20H2,1H3,(H,34,35)(H,37,38)	MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
CIBA-GEIGY Corporation Curated by ChEMBL					Assay Description Tested for 50% inhibition of Angiotensin converting enzyme(ACE) obtained from rabbit lung (in vitro)				J Med Chem 37: 1823-32 (1994) BindingDB Entry DOI: 10.7270/Q280537C
					More data for this Ligand-Target Pair