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SMILES: CN1C2CCC1[C@@H]([C@H]2CN1CCS[Re]2(=O)SCCN2CC1)c1ccc(Cl)cc1

InChI Key: InChIKey=SJLBXONBBSKFIP-IFNADWQYSA-L

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50062679   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))		BDBM50062679
PNG
(2-[[2-[[[3-(4-chlorophenyl)-8-methyl-8-azabicyclo[...)
Show SMILES CN1C2CCC1[C@@H]([C@H]2CN1CCS[Re]2(=O)SCCN2CC1)c1ccc(Cl)cc1 |TLB:8:7:1:4.3,THB:21:6:1:4.3|
Show InChI InChI=1S/C20H31ClN3S2.O.Re/c1-23-18-6-7-19(23)20(15-2-4-16(21)5-3-15)17(18)14-24(11-13-26)10-8-22-9-12-25;;/h2-5,17-20,25-26H,6-14H2,1H3;;/q-1;;+4/p-2/t17-,18?,19?,20+;;/m0../s1
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Similars
Article
PubMed
 13.9n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
In vitro bindingaffinity towards dopamine transporter in rat striatal homogenatewith [125I]-IPT as the radioligand

J Med Chem 41: 428-36 (1998)


Article DOI: 10.1021/jm970742b
BindingDB Entry DOI: 10.7270/Q2DN4459
More data for this
Ligand-Target Pair