BDBM50206082 CHEMBL397506::N-(2-amino-benzothiazol-6-yl)-thiophene-2-carboxamidine

SMILES: NC(=Nc1ccc2nc(N)sc2c1)c1cccs1

InChI Key: InChIKey=DOOGFJOHPWEHOH-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50206082   

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
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50206082 (CHEMBL397506 | N-(2-amino-benzothiazol-6-yl)-thiop...) Show SMILES NC(=Nc1ccc2nc(N)sc2c1)c1cccs1 |w:2.2| Show InChI InChI=1S/C12H10N4S2/c13-11(9-2-1-5-17-9)15-7-3-4-8-10(6-7)18-12(14)16-8/h1-6H,(H2,13,15)(H2,14,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
NeurAxon Inc. Curated by ChEMBL					Assay Description Inhibition of human neuronal NOS activity				Bioorg Med Chem Lett 17: 2540-4 (2007) Article DOI: 10.1016/j.bmcl.2007.02.011 BindingDB Entry DOI: 10.7270/Q2WM1F6B
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50206082 (CHEMBL397506 | N-(2-amino-benzothiazol-6-yl)-thiop...) Show SMILES NC(=Nc1ccc2nc(N)sc2c1)c1cccs1 |w:2.2| Show InChI InChI=1S/C12H10N4S2/c13-11(9-2-1-5-17-9)15-7-3-4-8-10(6-7)18-12(14)16-8/h1-6H,(H2,13,15)(H2,14,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
NeurAxon Inc. Curated by ChEMBL					Assay Description Inhibition of human endothelial NOS activity				Bioorg Med Chem Lett 17: 2540-4 (2007) Article DOI: 10.1016/j.bmcl.2007.02.011 BindingDB Entry DOI: 10.7270/Q2WM1F6B
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50206082 (CHEMBL397506 | N-(2-amino-benzothiazol-6-yl)-thiop...) Show SMILES NC(=Nc1ccc2nc(N)sc2c1)c1cccs1 |w:2.2| Show InChI InChI=1S/C12H10N4S2/c13-11(9-2-1-5-17-9)15-7-3-4-8-10(6-7)18-12(14)16-8/h1-6H,(H2,13,15)(H2,14,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
NeurAxon Inc. Curated by ChEMBL					Assay Description Inhibition of human inducible NOS activity				Bioorg Med Chem Lett 17: 2540-4 (2007) Article DOI: 10.1016/j.bmcl.2007.02.011 BindingDB Entry DOI: 10.7270/Q2WM1F6B
					More data for this Ligand-Target Pair