BDBM50017908 3-(5-Imidazol-1-ylmethyl-1-methyl-1H-pyrrol-2-yl)-acrylic acid::CHEMBL167601

SMILES: Cn1c(Cn2ccnc2)ccc1\C=C\C(O)=O

InChI Key: InChIKey=MAORBFCCJHJVGK-SNAWJCMRSA-N

Data: 1 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 1 hit for monomerid = 50017908   

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))	BDBM50017908 (3-(5-Imidazol-1-ylmethyl-1-methyl-1H-pyrrol-2-yl)-...) Show SMILES Cn1c(Cn2ccnc2)ccc1\C=C\C(O)=O Show InChI InChI=1S/C12H13N3O2/c1-14-10(4-5-12(16)17)2-3-11(14)8-15-7-6-13-9-15/h2-7,9H,8H2,1H3,(H,16,17)/b5-4+	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description Inhibition of thromboxane A2 synthetase as reduced ADP-induced aggregation of human platelet rich plasma in the presence of pig aortal microsomes				J Med Chem 32: 890-7 (1989) BindingDB Entry DOI: 10.7270/Q26W993X
					More data for this Ligand-Target Pair