BDBM50325187 4-Methyl-6-(((3S,4S)-4-((3'-(trifluoromethyl)biphenyl-4-yl)methoxy)pyrrolidin-3-yl)methyl)pyridin-2-amine::CHEMBL1222745

SMILES: Cc1cc(N)nc(C[C@@H]2CNC[C@@H]2OCc2ccc(cc2)-c2cccc(c2)C(F)(F)F)c1

InChI Key: InChIKey=TUMFAAOTAQZRGI-OFNKIYASSA-N

Data: 3 KI

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 = 50325187   

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, brain (Rattus norvegicus (rat))	BDBM50325187 (4-Methyl-6-(((3S,4S)-4-((3'-(trifluoromethyl)biphe...) Show SMILES Cc1cc(N)nc(C[C@@H]2CNC[C@@H]2OCc2ccc(cc2)-c2cccc(c2)C(F)(F)F)c1 |r| Show InChI InChI=1S/C25H26F3N3O/c1-16-9-22(31-24(29)10-16)12-20-13-30-14-23(20)32-15-17-5-7-18(8-6-17)19-3-2-4-21(11-19)25(26,27)28/h2-11,20,23,30H,12-15H2,1H3,(H2,29,31)/t20-,23+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	820	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Inhibition of rat recombinant nNOS expressed in Escherichia coli by hemoglobin capture assay				Bioorg Med Chem 18: 6526-37 (2010) Article DOI: 10.1016/j.bmc.2010.06.074 BindingDB Entry DOI: 10.7270/Q26110HX
					More data for this Ligand-Target Pair
Nitric Oxide Synthase, endothelial (Bos taurus (bovine))	BDBM50325187 (4-Methyl-6-(((3S,4S)-4-((3'-(trifluoromethyl)biphe...) Show SMILES Cc1cc(N)nc(C[C@@H]2CNC[C@@H]2OCc2ccc(cc2)-c2cccc(c2)C(F)(F)F)c1 |r| Show InChI InChI=1S/C25H26F3N3O/c1-16-9-22(31-24(29)10-16)12-20-13-30-14-23(20)32-15-17-5-7-18(8-6-17)19-3-2-4-21(11-19)25(26,27)28/h2-11,20,23,30H,12-15H2,1H3,(H2,29,31)/t20-,23+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.36E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Inhibition of bovine recombinant eNOS expressed in Escherichia coli by hemoglobin capture assay				Bioorg Med Chem 18: 6526-37 (2010) Article DOI: 10.1016/j.bmc.2010.06.074 BindingDB Entry DOI: 10.7270/Q26110HX
					More data for this Ligand-Target Pair
Nitric Oxide Synthase, inducible (Mus musculus (mouse))	BDBM50325187 (4-Methyl-6-(((3S,4S)-4-((3'-(trifluoromethyl)biphe...) Show SMILES Cc1cc(N)nc(C[C@@H]2CNC[C@@H]2OCc2ccc(cc2)-c2cccc(c2)C(F)(F)F)c1 |r| Show InChI InChI=1S/C25H26F3N3O/c1-16-9-22(31-24(29)10-16)12-20-13-30-14-23(20)32-15-17-5-7-18(8-6-17)19-3-2-4-21(11-19)25(26,27)28/h2-11,20,23,30H,12-15H2,1H3,(H2,29,31)/t20-,23+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.73E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Inhibition of mouse recombinant iNOS expressed in Escherichia coli by hemoglobin capture assay				Bioorg Med Chem 18: 6526-37 (2010) Article DOI: 10.1016/j.bmc.2010.06.074 BindingDB Entry DOI: 10.7270/Q26110HX
					More data for this Ligand-Target Pair