BDBM50090928 (2S)-2-amino-N-(3-aminopropyl)-5-{[(E)-imino(nitroamino)methyl]amino}pentanamide::CHEMBL92493::L-Arg NO2-NH-(CH2)3-NH2
SMILES: NCCCNC(=O)[C@@H](N)CCCNC(=N)N[N+]([O-])=O
InChI Key: InChIKey=DOPUEVHMERWSRG-ZETCQYMHSA-N
Data: 6 KI
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 |
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Nitric oxide synthase, brain (Homo sapiens (Human)) | BDBM50090928 ((2S)-2-amino-N-(3-aminopropyl)-5-{[(E)-imino(nitro...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 460 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University Curated by ChEMBL | Assay Description Binding affinity against bovine brain nNOS (neuronal). | J Med Chem 43: 2938-45 (2000) BindingDB Entry DOI: 10.7270/Q2NG4RBF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric-oxide synthase, brain (Rattus norvegicus (rat)) | BDBM50090928 ((2S)-2-amino-N-(3-aminopropyl)-5-{[(E)-imino(nitro...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 460 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University Curated by ChEMBL | Assay Description Inhibitory activity against recombinant rat nNOS. | J Med Chem 44: 2667-70 (2001) BindingDB Entry DOI: 10.7270/Q29K4BX1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric Oxide Synthase, inducible (Mus musculus (mouse)) | BDBM50090928 ((2S)-2-amino-N-(3-aminopropyl)-5-{[(E)-imino(nitro...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.18E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University Curated by ChEMBL | Assay Description Inhibitory activity against recombinant murine iNOS. | J Med Chem 44: 2667-70 (2001) BindingDB Entry DOI: 10.7270/Q29K4BX1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric Oxide Synthase, inducible (Mus musculus (mouse)) | BDBM50090928 ((2S)-2-amino-N-(3-aminopropyl)-5-{[(E)-imino(nitro...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.18E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University Curated by ChEMBL | Assay Description Binding affinity against recombinant murine Inducible nitric oxide synthase. | J Med Chem 43: 2938-45 (2000) BindingDB Entry DOI: 10.7270/Q2NG4RBF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric Oxide Synthase, endothelial (Bos taurus (bovine)) | BDBM50090928 ((2S)-2-amino-N-(3-aminopropyl)-5-{[(E)-imino(nitro...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 2.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University Curated by ChEMBL | Assay Description Inhibitory activity against recombinant bovine eNOS. | J Med Chem 44: 2667-70 (2001) BindingDB Entry DOI: 10.7270/Q29K4BX1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric Oxide Synthase, endothelial (Bos taurus (bovine)) | BDBM50090928 ((2S)-2-amino-N-(3-aminopropyl)-5-{[(E)-imino(nitro...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 2.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University Curated by ChEMBL | Assay Description Binding affinity against recombinant bovine Endothelial nitric oxide synthase. | J Med Chem 43: 2938-45 (2000) BindingDB Entry DOI: 10.7270/Q2NG4RBF | |||||||||||
More data for this Ligand-Target Pair |