BDBM50063301 CHEMBL164596::N-((5S,6R)-5-Amino-6,7-dihydroxy-heptyl)-acetamidine
SMILES: CC(=N)NCCCC[C@H](N)[C@@H](O)CO
InChI Key: InChIKey=SWFGZPKOOOLHNM-IUCAKERBSA-N
Data: 3 IC50
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, endothelial (Homo sapiens (Human)) | BDBM50063301 (CHEMBL164596 | N-((5S,6R)-5-Amino-6,7-dihydroxy-he...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 8.42E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Curated by ChEMBL | Assay Description Compound was evaluated for the Inhibition of endothelial isoform of Endothelial nitric oxide synthase (eNOS)enzyme | J Med Chem 41: 775-7 (1998) Article DOI: 10.1021/jm9706675 BindingDB Entry DOI: 10.7270/Q2VQ31TX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric oxide synthase, inducible (Homo sapiens (Human)) | BDBM50063301 (CHEMBL164596 | N-((5S,6R)-5-Amino-6,7-dihydroxy-he...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Curated by ChEMBL | Assay Description Compound was evaluated for the Inhibition of induced isoform of Inducible nitric oxide synthase | J Med Chem 41: 775-7 (1998) Article DOI: 10.1021/jm9706675 BindingDB Entry DOI: 10.7270/Q2VQ31TX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nitric oxide synthase, brain (Homo sapiens (Human)) | BDBM50063301 (CHEMBL164596 | N-((5S,6R)-5-Amino-6,7-dihydroxy-he...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 1.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Curated by ChEMBL | Assay Description Compound was evaluated for the Inhibition of Neuronal nitric oxide synthase | J Med Chem 41: 775-7 (1998) Article DOI: 10.1021/jm9706675 BindingDB Entry DOI: 10.7270/Q2VQ31TX | |||||||||||
More data for this Ligand-Target Pair |