BDBM50102683 CHEMBL313228::N-{(4S)-4-amino-5-[(3-aminopropyl)amino]pentyl}-N'-nitroguanidine
SMILES: NCCCNC[C@@H](N)CCCNC(=N)N[N+]([O-])=O
InChI Key: InChIKey=URNXGQJFPYGXFA-QMMMGPOBSA-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 (Rattus norvegicus (rat)) | BDBM50102683 (CHEMBL313228 | N-{(4S)-4-amino-5-[(3-aminopropyl)a...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 290 | 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, brain (Homo sapiens (Human)-Rattus norvegicus (rat)) | BDBM50102683 (CHEMBL313228 | N-{(4S)-4-amino-5-[(3-aminopropyl)a...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article 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 neuronal nitric oxide synthase | J Med Chem 46: 5700-11 (2003) Checked by Author Article DOI: 10.1021/jm030301u BindingDB Entry DOI: 10.7270/Q26D5TQV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric Oxide Synthase, inducible (Mus musculus (mouse)) | BDBM50102683 (CHEMBL313228 | N-{(4S)-4-amino-5-[(3-aminopropyl)a...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 7.30E+4 | 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)-Homo sapiens (Human)) | BDBM50102683 (CHEMBL313228 | N-{(4S)-4-amino-5-[(3-aminopropyl)a...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.23E+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 Inducible nitric oxide synthase | J Med Chem 46: 5700-11 (2003) Checked by Author Article DOI: 10.1021/jm030301u BindingDB Entry DOI: 10.7270/Q26D5TQV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric Oxide Synthase, endothelial (Homo sapiens (Human)-Bos taurus (bovine)) | BDBM50102683 (CHEMBL313228 | N-{(4S)-4-amino-5-[(3-aminopropyl)a...) | PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 4.11E+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 endothelial nitric oxide synthase (eNOS) | J Med Chem 46: 5700-11 (2003) Checked by Author Article DOI: 10.1021/jm030301u BindingDB Entry DOI: 10.7270/Q26D5TQV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric Oxide Synthase, endothelial (Bos taurus (bovine)) | BDBM50102683 (CHEMBL313228 | N-{(4S)-4-amino-5-[(3-aminopropyl)a...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 5.24E+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 |