BDBM50065817 2-Amino-N-(3-aminomethyl-phenyl)-acetamidine::CHEMBL542675

SMILES: NCC(N)=Nc1cccc(CN)c1

InChI Key: InChIKey=BWNWOGRCONOOAQ-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50065817   

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))	BDBM50065817 (2-Amino-N-(3-aminomethyl-phenyl)-acetamidine | CHE...) Show SMILES NCC(N)=Nc1cccc(CN)c1 |w:4.4| Show InChI InChI=1S/C9H14N4/c10-5-7-2-1-3-8(4-7)13-9(12)6-11/h1-4H,5-6,10-11H2,(H2,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	190	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glaxo Wellcome Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against human neuronal nitric oxide synthase (nNOS) isoenzyme.				J Med Chem 41: 2858-71 (1998) Article DOI: 10.1021/jm980072p BindingDB Entry DOI: 10.7270/Q2862H4X
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50065817 (2-Amino-N-(3-aminomethyl-phenyl)-acetamidine | CHE...) Show SMILES NCC(N)=Nc1cccc(CN)c1 |w:4.4| Show InChI InChI=1S/C9H14N4/c10-5-7-2-1-3-8(4-7)13-9(12)6-11/h1-4H,5-6,10-11H2,(H2,12,13)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glaxo Wellcome Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against human inducible nitric oxide synthase (iNOS) isoenzyme.				J Med Chem 41: 2858-71 (1998) Article DOI: 10.1021/jm980072p BindingDB Entry DOI: 10.7270/Q2862H4X
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50065817 (2-Amino-N-(3-aminomethyl-phenyl)-acetamidine | CHE...) Show SMILES NCC(N)=Nc1cccc(CN)c1 |w:4.4| Show InChI InChI=1S/C9H14N4/c10-5-7-2-1-3-8(4-7)13-9(12)6-11/h1-4H,5-6,10-11H2,(H2,12,13)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glaxo Wellcome Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against human endothelial nitric oxide synthase (eNOS) isoenzyme.				J Med Chem 41: 2858-71 (1998) Article DOI: 10.1021/jm980072p BindingDB Entry DOI: 10.7270/Q2862H4X
					More data for this Ligand-Target Pair