BindingDB PrimarySearch

BDBM50030279 2-Amino-5-(N'-methyl-guanidino)-pentanoic acid::CHEMBL312870

SMILES: CNC(=N)NCCCC(N)C(O)=O

InChI Key: InChIKey=NTNWOCRCBQPEKQ-UHFFFAOYSA-N

Data: 3 KI 8 IC50

PDB links: 18 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 50030279
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Nitric Oxide Synthase, endothelial (Bos taurus (bovine))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Compound was tested for binding affinity against Endothelial nitric oxide synthase				J Med Chem 40: 3869-70 (1998) Article DOI: 10.1021/jm970550g BindingDB Entry DOI: 10.7270/Q2C829ZT
Northwestern University Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric-oxide synthase, brain (Rattus norvegicus (rat))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Compound was tested for binding affinity against neuronal nitric oxide synthase(nNOS)				J Med Chem 40: 3869-70 (1998) Article DOI: 10.1021/jm970550g BindingDB Entry DOI: 10.7270/Q2C829ZT
Northwestern University Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric Oxide Synthase, inducible (Mus musculus (mouse))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Compound was tested for binding affinity against recombinant inducible nitric oxide synthase (iNOS) from mouse				J Med Chem 40: 3869-70 (1998) Article DOI: 10.1021/jm970550g BindingDB Entry DOI: 10.7270/Q2C829ZT
Northwestern University Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R& D Charnwood Curated by ChEMBL					Assay Description Inhibitory activity against human neuronal nitiric oxide synthase				J Med Chem 46: 913-6 (2003) Article DOI: 10.1021/jm0255926 BindingDB Entry DOI: 10.7270/Q2S75H3M
AstraZeneca R& D Charnwood Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Rattus norvegicus)	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
G. D. Searle Research and Development Curated by ChEMBL					Assay Description Tested for inhibition of rat brain inducible nitric oxide synthase				J Med Chem 37: 3886-8 (1994) BindingDB Entry DOI: 10.7270/Q29P328V
G. D. Searle Research and Development Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R& D Charnwood Curated by ChEMBL					Assay Description Inhibitory activity against human endothelial nitiric oxide synthase				J Med Chem 46: 913-6 (2003) Article DOI: 10.1021/jm0255926 BindingDB Entry DOI: 10.7270/Q2S75H3M
AstraZeneca R& D Charnwood Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R& D Charnwood Curated by ChEMBL					Assay Description Inhibitory activity of compound against human inducible nitiric oxide synthase				J Med Chem 46: 913-6 (2003) Article DOI: 10.1021/jm0255926 BindingDB Entry DOI: 10.7270/Q2S75H3M
AstraZeneca R& D Charnwood Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	890	n/a	n/a	n/a	n/a	n/a	n/a
Schering AG Curated by ChEMBL					Assay Description Concentration required to inhibit neuronal nitric oxide synthase				Bioorg Med Chem Lett 12: 2561-4 (2002) BindingDB Entry DOI: 10.7270/Q2VD6XS8
Schering AG Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Schering AG Curated by ChEMBL					Assay Description In vitro inhibition of inducible nitric oxide synthase.				Bioorg Med Chem Lett 12: 2561-4 (2002) BindingDB Entry DOI: 10.7270/Q2VD6XS8
Schering AG Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Schering AG Curated by ChEMBL					Assay Description In vitro inhibition of endothelial nitric oxide synthase.				Bioorg Med Chem Lett 12: 2561-4 (2002) BindingDB Entry DOI: 10.7270/Q2VD6XS8
Schering AG Curated by ChEMBL					More data for this Ligand-Target Pair
Nitric Oxide Synthase, inducible (Mus musculus (mouse))	BDBM50030279 (2-Amino-5-(N'-methyl-guanidino)-pentanoic acid \| C...) Show SMILES CNC(=N)NCCCC(N)C(O)=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	8.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
G. D. Searle Research and Development Curated by ChEMBL					Assay Description Tested for inhibition of mouse inducible nitric oxide synthase				J Med Chem 37: 3886-8 (1994) BindingDB Entry DOI: 10.7270/Q29P328V
G. D. Searle Research and Development Curated by ChEMBL					More data for this Ligand-Target Pair