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Attributes

UniProt ID
Protein Name
Nitric oxide synthase 1
Ligand Name
6-{[(3R,4R)-4-(2-{[2-(3-fluorophenyl)ethyl]amino}ethoxy)pyrrolidin-3-yl]methyl}-4-methylpyridin-2-amine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NESZTSPBRDBHCW-XLIONFOSSA-N
SMILES
Cc1cc(nc(c1)N)CC2CNCC2OCCNCCc3cccc(c3)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 3NLJ
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Color Legend
Unassigned regionsLigand / hetero atomse3nljA1e3nljB1
ECOD domains from experimental PDB structures interacting with ligand JRR
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P29476n/aJRR3nlje3nljA1A:299-716
P29476n/aJRR3nlje3nljB1B:299-718
P29476n/aJRR3nlme3nlmA1A:299-716
P29476n/aJRR3nlme3nlmB1B:299-718
P29476n/aJRR3nlqe3nlqA1A:299-716
P29476n/aJRR3nlqe3nlqB1B:299-718