null

SMILES: COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1

InChI Key: InChIKey=PPFHWDUQKZIRKR-RGCHAYFUSA-K

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50279764   

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 (Macaca fascicularis)	BDBM50279764 (CHEMBL55730 | Diastereiosomer of[N-[2-[(3'-N'-Prop...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C31H41F2N3O4S2.O.Re/c1-39-31(38)29-26-12-11-25(36(26)15-2-14-35(16-18-42)20-28(37)34-13-17-41)19-27(29)40-30(21-3-7-23(32)8-4-21)22-5-9-24(33)10-6-22;;/h3-10,25-27,29-30H,2,11-20H2,1H3,(H3,34,37,41,42);;/q;;+4/p-3/t25?,26?,27-,29+;;/m0../s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	343	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50279764 (CHEMBL55730 | Diastereiosomer of[N-[2-[(3'-N'-Prop...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C31H41F2N3O4S2.O.Re/c1-39-31(38)29-26-12-11-25(36(26)15-2-14-35(16-18-42)20-28(37)34-13-17-41)19-27(29)40-30(21-3-7-23(32)8-4-21)22-5-9-24(33)10-6-22;;/h3-10,25-27,29-30H,2,11-20H2,1H3,(H3,34,37,41,42);;/q;;+4/p-3/t25?,26?,27-,29+;;/m0../s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	343	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50279764 (CHEMBL55730 | Diastereiosomer of[N-[2-[(3'-N'-Prop...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C31H41F2N3O4S2.O.Re/c1-39-31(38)29-26-12-11-25(36(26)15-2-14-35(16-18-42)20-28(37)34-13-17-41)19-27(29)40-30(21-3-7-23(32)8-4-21)22-5-9-24(33)10-6-22;;/h3-10,25-27,29-30H,2,11-20H2,1H3,(H3,34,37,41,42);;/q;;+4/p-3/t25?,26?,27-,29+;;/m0../s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	5.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair