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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50010593'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50010593
PNG
(1-(2-Chloro-5-isopropylidene-5H-dibenzo[a,d]cycloh...)
Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2cc(Cl)ccc2\[#6](=[#6](/[#6])-[#6])-c2ccccc-12 |t:8|
Show InChI InChI=1S/C23H25ClN2/c1-16(2)23-19-9-8-18(24)14-17(19)15-22(20-6-4-5-7-21(20)23)26-12-10-25(3)11-13-26/h4-9,14-15H,10-13H2,1-3H3
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PC cid
PC sid
UniChem

Similars

PubMed
690n/an/an/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Affinity was evaluated by inhibition of [3H]-spiperone binding to COS cells transfected with human dopamine D-2(long) receptor


J Med Chem 37: 2686-96 (1994)


BindingDB Entry DOI: 10.7270/Q28051NX
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50010593
PNG
(1-(2-Chloro-5-isopropylidene-5H-dibenzo[a,d]cycloh...)
Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2cc(Cl)ccc2\[#6](=[#6](/[#6])-[#6])-c2ccccc-12 |t:8|
Show InChI InChI=1S/C23H25ClN2/c1-16(2)23-19-9-8-18(24)14-17(19)15-22(20-6-4-5-7-21(20)23)26-12-10-25(3)11-13-26/h4-9,14-15H,10-13H2,1-3H3
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PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Binding affinity for Dopamine receptor D2 using [3H]-spiperone in rat brain


J Med Chem 33: 809-14 (1990)


BindingDB Entry DOI: 10.7270/Q2348JCH
More data for this
Ligand-Target Pair