BDBM50115150 2-Amino-6-methylaminomethyl-5,6,7,8-tetrahydro-3H-pteridin-4-one::CHEMBL420453

SMILES: CNCC1CNc2nc(N)[nH]c(=O)c2N1

InChI Key: InChIKey=LHIQNSIRCHEIBK-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50115150   

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))	BDBM50115150 (2-Amino-6-methylaminomethyl-5,6,7,8-tetrahydro-3H-...) Show SMILES CNCC1CNc2nc(N)[nH]c(=O)c2N1 Show InChI InChI=1S/C8H14N6O/c1-10-2-4-3-11-6-5(12-4)7(15)14-8(9)13-6/h4,10,12H,2-3H2,1H3,(H4,9,11,13,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Aventis Pharma Curated by ChEMBL					Assay Description Inhibitory activity against human neuronal nitric oxide synthase (NOS-I)				J Med Chem 45: 2923-41 (2002) BindingDB Entry DOI: 10.7270/Q2571BBK
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50115150 (2-Amino-6-methylaminomethyl-5,6,7,8-tetrahydro-3H-...) Show SMILES CNCC1CNc2nc(N)[nH]c(=O)c2N1 Show InChI InChI=1S/C8H14N6O/c1-10-2-4-3-11-6-5(12-4)7(15)14-8(9)13-6/h4,10,12H,2-3H2,1H3,(H4,9,11,13,14,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Curated by ChEMBL					Assay Description Inhibitory activity against human Nitric oxide synthase-III with 2 uM H4Bip for 30 min				J Med Chem 48: 4783-92 (2005) Article DOI: 10.1021/jm050007x BindingDB Entry DOI: 10.7270/Q28W3CTH
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50115150 (2-Amino-6-methylaminomethyl-5,6,7,8-tetrahydro-3H-...) Show SMILES CNCC1CNc2nc(N)[nH]c(=O)c2N1 Show InChI InChI=1S/C8H14N6O/c1-10-2-4-3-11-6-5(12-4)7(15)14-8(9)13-6/h4,10,12H,2-3H2,1H3,(H4,9,11,13,14,15)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Curated by ChEMBL					Assay Description Inhibitory activity against human Nitric oxide synthase-II with 2 uM H4Bip for 30 min				J Med Chem 48: 4783-92 (2005) Article DOI: 10.1021/jm050007x BindingDB Entry DOI: 10.7270/Q28W3CTH
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50115150 (2-Amino-6-methylaminomethyl-5,6,7,8-tetrahydro-3H-...) Show SMILES CNCC1CNc2nc(N)[nH]c(=O)c2N1 Show InChI InChI=1S/C8H14N6O/c1-10-2-4-3-11-6-5(12-4)7(15)14-8(9)13-6/h4,10,12H,2-3H2,1H3,(H4,9,11,13,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Curated by ChEMBL					Assay Description Inhibitory activity against human Nitric oxide synthase-I with 2 uM H4Bip for 30 min				J Med Chem 48: 4783-92 (2005) Article DOI: 10.1021/jm050007x BindingDB Entry DOI: 10.7270/Q28W3CTH
					More data for this Ligand-Target Pair