BDBM50196225 CHEMBL217295::S-(+)-2beta-Hydroxymethyl-3alpha-[bis(4-fluorophenyl)methoxy]-tropane

SMILES: CN1C2CCC1[C@@H](CO)[C@H](C2)OC(c1ccc(F)cc1)c1ccc(F)cc1

InChI Key: InChIKey=DHPAYGMVHAIWBY-KOQKOIQBSA-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 = 50196225   

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))	BDBM50196225 (CHEMBL217295 | S-(+)-2beta-Hydroxymethyl-3alpha-[b...) Show SMILES CN1C2CCC1[C@@H](CO)[C@H](C2)OC(c1ccc(F)cc1)c1ccc(F)cc1 |TLB:7:6:1:3.4,THB:11:9:1:3.4| Show InChI InChI=1S/C22H25F2NO2/c1-25-18-10-11-20(25)19(13-26)21(12-18)27-22(14-2-6-16(23)7-3-14)15-4-8-17(24)9-5-15/h2-9,18-22,26H,10-13H2,1H3/t18?,19-,20?,21+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.40	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 DAT in Sprague-Dawley rat brain				J Med Chem 49: 6391-9 (2006) Article DOI: 10.1021/jm060762q BindingDB Entry DOI: 10.7270/Q2WD41D4
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50196225 (CHEMBL217295 | S-(+)-2beta-Hydroxymethyl-3alpha-[b...) Show SMILES CN1C2CCC1[C@@H](CO)[C@H](C2)OC(c1ccc(F)cc1)c1ccc(F)cc1 |TLB:7:6:1:3.4,THB:11:9:1:3.4| Show InChI InChI=1S/C22H25F2NO2/c1-25-18-10-11-20(25)19(13-26)21(12-18)27-22(14-2-6-16(23)7-3-14)15-4-8-17(24)9-5-15/h2-9,18-22,26H,10-13H2,1H3/t18?,19-,20?,21+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	109	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 M1 receptor in Sprague-Dawley rat brain				J Med Chem 49: 6391-9 (2006) Article DOI: 10.1021/jm060762q BindingDB Entry DOI: 10.7270/Q2WD41D4
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50196225 (CHEMBL217295 | S-(+)-2beta-Hydroxymethyl-3alpha-[b...) Show SMILES CN1C2CCC1[C@@H](CO)[C@H](C2)OC(c1ccc(F)cc1)c1ccc(F)cc1 |TLB:7:6:1:3.4,THB:11:9:1:3.4| Show InChI InChI=1S/C22H25F2NO2/c1-25-18-10-11-20(25)19(13-26)21(12-18)27-22(14-2-6-16(23)7-3-14)15-4-8-17(24)9-5-15/h2-9,18-22,26H,10-13H2,1H3/t18?,19-,20?,21+/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	910	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 SERT in Sprague-Dawley rat brain				J Med Chem 49: 6391-9 (2006) Article DOI: 10.1021/jm060762q BindingDB Entry DOI: 10.7270/Q2WD41D4
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50196225 (CHEMBL217295 | S-(+)-2beta-Hydroxymethyl-3alpha-[b...) Show SMILES CN1C2CCC1[C@@H](CO)[C@H](C2)OC(c1ccc(F)cc1)c1ccc(F)cc1 |TLB:7:6:1:3.4,THB:11:9:1:3.4| Show InChI InChI=1S/C22H25F2NO2/c1-25-18-10-11-20(25)19(13-26)21(12-18)27-22(14-2-6-16(23)7-3-14)15-4-8-17(24)9-5-15/h2-9,18-22,26H,10-13H2,1H3/t18?,19-,20?,21+/m1/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	983	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]nisoxetine from NET in Sprague-Dawley rat brain				J Med Chem 49: 6391-9 (2006) Article DOI: 10.1021/jm060762q BindingDB Entry DOI: 10.7270/Q2WD41D4
					More data for this Ligand-Target Pair