BDBM50147594 (S)-3-[Bis-(4-fluoro-phenyl)-methoxy]-8-methyl-8-aza-bicyclo[3.2.1]octan-6-ol::CHEMBL112825

SMILES: CN1C2C[C@H](O)C1CC(C2)OC(c1ccc(F)cc1)c1ccc(F)cc1

InChI Key: InChIKey=NRKFYDQWSIYFGJ-WSXZXBBNSA-N

Data: 4 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 4 hits for monomerid = 50147594   

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
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50147594 ((S)-3-[Bis-(4-fluoro-phenyl)-methoxy]-8-methyl-8-a...) Show SMILES CN1C2C[C@H](O)C1CC(C2)OC(c1ccc(F)cc1)c1ccc(F)cc1 |TLB:5:4:1:7.9.8,THB:10:8:1:3.4| Show InChI InChI=1S/C21H23F2NO2/c1-24-17-10-18(12-19(24)20(25)11-17)26-21(13-2-6-15(22)7-3-13)14-4-8-16(23)9-5-14/h2-9,17-21,25H,10-12H2,1H3/t17?,18?,19?,20-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse--Intramural Research Program Curated by ChEMBL					Assay Description Displacement of [3H]WIN-35428 from dopamine transporter of rat brain membrane				Bioorg Med Chem Lett 14: 3295-8 (2004) Article DOI: 10.1016/j.bmcl.2004.03.075 BindingDB Entry DOI: 10.7270/Q2F76D43
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50147594 ((S)-3-[Bis-(4-fluoro-phenyl)-methoxy]-8-methyl-8-a...) Show SMILES CN1C2C[C@H](O)C1CC(C2)OC(c1ccc(F)cc1)c1ccc(F)cc1 |TLB:5:4:1:7.9.8,THB:10:8:1:3.4| Show InChI InChI=1S/C21H23F2NO2/c1-24-17-10-18(12-19(24)20(25)11-17)26-21(13-2-6-15(22)7-3-13)14-4-8-16(23)9-5-14/h2-9,17-21,25H,10-12H2,1H3/t17?,18?,19?,20-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	48	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse--Intramural Research Program Curated by ChEMBL					Assay Description Displacement of [3H]pirenzepine from muscarinic acetylcholine receptor M1 of rat brain membrane				Bioorg Med Chem Lett 14: 3295-8 (2004) Article DOI: 10.1016/j.bmcl.2004.03.075 BindingDB Entry DOI: 10.7270/Q2F76D43
					More data for this Ligand-Target Pair
Norepinephrine Monoamine transporters (Rattus norvegicus)	BDBM50147594 ((S)-3-[Bis-(4-fluoro-phenyl)-methoxy]-8-methyl-8-a...) Show SMILES CN1C2C[C@H](O)C1CC(C2)OC(c1ccc(F)cc1)c1ccc(F)cc1 |TLB:5:4:1:7.9.8,THB:10:8:1:3.4| Show InChI InChI=1S/C21H23F2NO2/c1-24-17-10-18(12-19(24)20(25)11-17)26-21(13-2-6-15(22)7-3-13)14-4-8-16(23)9-5-14/h2-9,17-21,25H,10-12H2,1H3/t17?,18?,19?,20-/m0/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse--Intramural Research Program Curated by ChEMBL					Assay Description Displacement of [3H]-nisoxatine from norepinephrine transporter of rat brain membrane				Bioorg Med Chem Lett 14: 3295-8 (2004) Article DOI: 10.1016/j.bmcl.2004.03.075 BindingDB Entry DOI: 10.7270/Q2F76D43
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50147594 ((S)-3-[Bis-(4-fluoro-phenyl)-methoxy]-8-methyl-8-a...) Show SMILES CN1C2C[C@H](O)C1CC(C2)OC(c1ccc(F)cc1)c1ccc(F)cc1 |TLB:5:4:1:7.9.8,THB:10:8:1:3.4| Show InChI InChI=1S/C21H23F2NO2/c1-24-17-10-18(12-19(24)20(25)11-17)26-21(13-2-6-15(22)7-3-13)14-4-8-16(23)9-5-14/h2-9,17-21,25H,10-12H2,1H3/t17?,18?,19?,20-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.09E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse--Intramural Research Program Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from serotonin transporter of rat brain membrane				Bioorg Med Chem Lett 14: 3295-8 (2004) Article DOI: 10.1016/j.bmcl.2004.03.075 BindingDB Entry DOI: 10.7270/Q2F76D43
					More data for this Ligand-Target Pair