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BDBM50369652 CHEMBL1202215

SMILES: Clc1ccccc1N1CCN(C[C@H]2C[C@@H]2c2ccccc2)CC1

InChI Key: InChIKey=JVYYIOXKIUYPJI-QZTJIDSGSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50369652   
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
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50369652
PNG
(CHEMBL1202215)
Show SMILES Clc1ccccc1N1CCN(C[C@H]2C[C@@H]2c2ccccc2)CC1 |r|
Show InChI InChI=1S/C20H23ClN2/c21-19-8-4-5-9-20(19)23-12-10-22(11-13-23)15-17-14-18(17)16-6-2-1-3-7-16/h1-9,17-18H,10-15H2/t17-,18-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 5n/an/an/an/an/an/a



Neurogen Corporation

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 cloned from human, using [3H]- YM09151 as competitive ligand


J Med Chem 43: 3923-32 (2000)


BindingDB Entry DOI: 10.7270/Q2HM595B
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50369652
PNG
(CHEMBL1202215)
Show SMILES Clc1ccccc1N1CCN(C[C@H]2C[C@@H]2c2ccccc2)CC1 |r|
Show InChI InChI=1S/C20H23ClN2/c21-19-8-4-5-9-20(19)23-12-10-22(11-13-23)15-17-14-18(17)16-6-2-1-3-7-16/h1-9,17-18H,10-15H2/t17-,18-/m1/s1
Reactome pathway
KEGG

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 8n/an/an/an/an/an/a



Neurogen Corporation

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D4 cloned from human, using [3H]- YM09151 as competitive ligand


J Med Chem 43: 3923-32 (2000)


BindingDB Entry DOI: 10.7270/Q2HM595B
More data for this
Ligand-Target Pair