BDBM50120679 2-Imino-4-methyl-5-pentyl-pyrrolidin-3-ol::CHEMBL321446

SMILES: CCCCC[C@H]1N=C(N)[C@H](O)[C@H]1C

InChI Key: InChIKey=DBFJQSOVVMBTEE-DJLDLDEBSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50120679   

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))	BDBM50120679 (2-Imino-4-methyl-5-pentyl-pyrrolidin-3-ol | CHEMBL...) Show SMILES CCCCC[C@H]1N=C(N)[C@H](O)[C@H]1C |t:6| Show InChI InChI=1S/C10H20N2O/c1-3-4-5-6-8-7(2)9(13)10(11)12-8/h7-9,13H,3-6H2,1-2H3,(H2,11,12)/t7-,8+,9+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.95E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia Curated by ChEMBL					Assay Description Inhibitory concentration of the compound was tested against Endothelial nitric oxide synthase				Bioorg Med Chem Lett 12: 3337-9 (2002) BindingDB Entry DOI: 10.7270/Q22F7MS4
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50120679 (2-Imino-4-methyl-5-pentyl-pyrrolidin-3-ol | CHEMBL...) Show SMILES CCCCC[C@H]1N=C(N)[C@H](O)[C@H]1C |t:6| Show InChI InChI=1S/C10H20N2O/c1-3-4-5-6-8-7(2)9(13)10(11)12-8/h7-9,13H,3-6H2,1-2H3,(H2,11,12)/t7-,8+,9+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia Curated by ChEMBL					Assay Description Inhibitory concentration of the compound was tested against Neuronal nitric oxide synthase				Bioorg Med Chem Lett 12: 3337-9 (2002) BindingDB Entry DOI: 10.7270/Q22F7MS4
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50120679 (2-Imino-4-methyl-5-pentyl-pyrrolidin-3-ol | CHEMBL...) Show SMILES CCCCC[C@H]1N=C(N)[C@H](O)[C@H]1C |t:6| Show InChI InChI=1S/C10H20N2O/c1-3-4-5-6-8-7(2)9(13)10(11)12-8/h7-9,13H,3-6H2,1-2H3,(H2,11,12)/t7-,8+,9+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia Curated by ChEMBL					Assay Description Inhibitory concentration of the compound was tested against Inducible nitric oxide synthase (iNOS)				Bioorg Med Chem Lett 12: 3337-9 (2002) BindingDB Entry DOI: 10.7270/Q22F7MS4
					More data for this Ligand-Target Pair