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Target
Sodium-dependent dopamine transporter
Ligand
BDBM50304066
Substrate
n/a
Meas. Tech.
ChEMBL_601509 (CHEMBL1044204)
Ki
890±n/a nM
Citation
 Nielsen, S; Pedersen, CM; Hansen, SG; Petersen, MD; Sinning, S; Wiborg, O; Jensen, HH; Bols, M An extended study of dimeric phenyl tropanes. Bioorg Med Chem 17:4900-9 (2009) [PubMed]  Article
Target
Name:
Sodium-dependent dopamine transporter
Synonyms:
DA transporter | DAT | DAT1 | Dopamine transporter (DAT) | Dopamine transporter protein (DAT) | Monoamine transporter | SC6A3_HUMAN | SLC6A3 | Sodium-dependent dopamine transporter | Sodium-dependent dopamine transporter (DAT) | Solute carrier family 6 member 3
Type:
Multi-pass membrane protein
Mol. Mass.:
68497.11
Organism:
Homo sapiens (Human)
Description:
Q01959
Residue:
620
Sequence:
MSKSKCSVGLMSSVVAPAKEPNAVGPKEVELILVKEQNGVQLTSSTLTNPRQSPVEAQDRETWGKKIDFLLSVIGFAVDLANVWRFPYLCYKNGGGAFLVPYLLFMVIAGMPLFYMELALGQFNREGAAGVWKICPILKGVGFTVILISLYVGFFYNVIIAWALHYLFSSFTTELPWIHCNNSWNSPNCSDAHPGDSSGDSSGLNDTFGTTPAAEYFERGVLHLHQSHGIDDLGPPRWQLTACLVLVIVLLYFSLWKGVKTSGKVVWITATMPYVVLTALLLRGVTLPGAIDGIRAYLSVDFYRLCEASVWIDAATQVCFSLGVGFGVLIAFSSYNKFTNNCYRDAIVTTSINSLTSFSSGFVVFSFLGYMAQKHSVPIGDVAKDGPGLIFIIYPEAIATLPLSSAWAVVFFIMLLTLGIDSAMGGMESVITGLIDEFQLLHRHRELFTLFIVLATFLLSLFCVTNGGIYVFTLLDHFAAGTSILFGVLIEAIGVAWFYGVGQFSDDIQQMTGQRPSLYWRLCWKLVSPCFLLFVVVVSIVTFRPPHYGAYIFPDWANALGWVIATSSMAMVPIYAAYKFCSLPGSFREKLAYAIAPEKDRELVDRGEVRQFTLRHWLKV
  
Inhibitor
Name:
BDBM50304066
Synonyms:
CHEMBL595539 | trans-1,4-Di[3beta-(4-chlorophenyl)tropane-2beta-carbonylamino]cyclohexane
Type:
Small organic molecule
Emp. Form.:
C36H46Cl2N4O2
Mol. Mass.:
637.682
SMILES:
CN1C2CCC1[C@@H]([C@H](C2)c1ccc(Cl)cc1)C(=O)N[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)cc1)N2C |r,wU:28.31,34.39,22.28,7.10,6.18,wD:19.21,TLB:16:6:1:3.4,35:34:42:30.31,THB:9:7:1:3.4,26:28:42:30.31,(9.06,-3.73,;8.3,-5.07,;7.25,-5.92,;7.89,-7.24,;9.07,-7.94,;8.06,-6.61,;6.23,-6.64,;5.27,-7.48,;5.5,-5.93,;4.48,-8.81,;5.25,-10.14,;4.47,-11.46,;2.93,-11.45,;2.15,-12.78,;2.18,-10.11,;2.96,-8.78,;5.61,-4.72,;6.4,-3.4,;4.08,-4.7,;2.74,-5.47,;1.4,-4.69,;.05,-5.46,;.06,-7.01,;1.4,-7.78,;2.73,-7.01,;-1.28,-7.79,;-2.61,-7.01,;-2.61,-5.47,;-3.94,-7.79,;-5.66,-7.47,;-6.52,-8.66,;-7.81,-9.14,;-6.58,-8.01,;-4.78,-8.36,;-3.98,-9.35,;-3.27,-10.72,;-4.11,-12.01,;-3.41,-13.37,;-1.87,-13.45,;-1.16,-14.81,;-1.04,-12.15,;-1.75,-10.78,;-6.54,-6.45,;-7.05,-5,)|
Structure:
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