BDBM50307334 5-(3,4-Dimethoxyphenyl)benzo[b]thiophene-2-carboxamidine::CHEMBL598384

SMILES: COc1ccc(cc1OC)-c1ccc2sc(cc2c1)C(N)=N

InChI Key: InChIKey=FHFYJPXHDJXVJS-UHFFFAOYSA-N

Data: 2 KI

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 = 50307334   

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
Coagulation factor IX (Homo sapiens (Human))	BDBM50307334 (5-(3,4-Dimethoxyphenyl)benzo[b]thiophene-2-carboxa...) Show SMILES COc1ccc(cc1OC)-c1ccc2sc(cc2c1)C(N)=N Show InChI InChI=1S/C17H16N2O2S/c1-20-13-5-3-11(8-14(13)21-2)10-4-6-15-12(7-10)9-16(22-15)17(18)19/h3-9H,1-2H3,(H3,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	MMDB Article PubMed	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trigen Ltd. Curated by ChEMBL					Assay Description Inhibition of human recombinant factor 9a by amidolytic assay				J Med Chem 53: 1465-72 (2010) Article DOI: 10.1021/jm901475e BindingDB Entry DOI: 10.7270/Q22N5372
					More data for this Ligand-Target Pair				3D Structure (docked)
Coagulation factor X (Homo sapiens (Human))	BDBM50307334 (5-(3,4-Dimethoxyphenyl)benzo[b]thiophene-2-carboxa...) Show SMILES COc1ccc(cc1OC)-c1ccc2sc(cc2c1)C(N)=N Show InChI InChI=1S/C17H16N2O2S/c1-20-13-5-3-11(8-14(13)21-2)10-4-6-15-12(7-10)9-16(22-15)17(18)19/h3-9H,1-2H3,(H3,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	1.19E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trigen Ltd. Curated by ChEMBL					Assay Description Inhibition of factor 10 by amidolytic assay				J Med Chem 53: 1465-72 (2010) Article DOI: 10.1021/jm901475e BindingDB Entry DOI: 10.7270/Q22N5372
					More data for this Ligand-Target Pair