BDBM50297432 3-(4-methoxyphenyl)-5-(thiophen-2-yl)-N-vinyl-4,5-dihydro-1H-pyrazole-1-carbothioamide::CHEMBL551278

SMILES: COc1ccc(cc1)C1=NN(C(C1)c1cccs1)C(=S)N=CC

InChI Key: InChIKey=DIPCKSPUDPNHGK-UHFFFAOYSA-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 = 50297432   

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
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50297432 (3-(4-methoxyphenyl)-5-(thiophen-2-yl)-N-vinyl-4,5-...) Show SMILES COc1ccc(cc1)C1=NN(C(C1)c1cccs1)C(=S)N=CC |w:21.24,t:9| Show InChI InChI=1S/C17H17N3OS2/c1-3-18-17(22)20-15(16-5-4-10-23-16)11-14(19-20)12-6-8-13(21-2)9-7-12/h3-10,15H,11H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
GVK Biosciences Pvt. Ltd. Curated by ChEMBL					Assay Description Inhibition of MAOB				Eur J Med Chem 44: 3584-90 (2009) Article DOI: 10.1016/j.ejmech.2009.02.031 BindingDB Entry DOI: 10.7270/Q2Z60P4F
					More data for this Ligand-Target Pair