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SMILES: Cc1c(-c2ccccc2)n(C)c(=O)n1C1CCN(Cc2ccccc2)CC1

InChI Key: InChIKey=BXEHOLVBINGZIE-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50079181   
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(4) dopamine receptor


(Homo sapiens (Human))
BDBM50079181
PNG
(1-(1-Benzyl-piperidin-4-yl)-3,5-dimethyl-4-phenyl-...)
Show SMILES Cc1c(-c2ccccc2)n(C)c(=O)n1C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C23H27N3O/c1-18-22(20-11-7-4-8-12-20)24(2)23(27)26(18)21-13-15-25(16-14-21)17-19-9-5-3-6-10-19/h3-12,21H,13-17H2,1-2H3
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Article
PubMed
0.75n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Affinity to displace [3H]-spiperone from cloned human Dopamine receptor D4 stably expressed in HEK-393 cell lines


J Med Chem 42: 2706-15 (1999)


Article DOI: 10.1021/jm991029k
BindingDB Entry DOI: 10.7270/Q2P55MPV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50079181
PNG
(1-(1-Benzyl-piperidin-4-yl)-3,5-dimethyl-4-phenyl-...)
Show SMILES Cc1c(-c2ccccc2)n(C)c(=O)n1C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C23H27N3O/c1-18-22(20-11-7-4-8-12-20)24(2)23(27)26(18)21-13-15-25(16-14-21)17-19-9-5-3-6-10-19/h3-12,21H,13-17H2,1-2H3
PDB

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PC sid
UniChem

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Article
PubMed
15n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Affinity to displace [3H]-spiperone from cloned human Dopamine receptor D2 stably expressed in CHO cell lines


J Med Chem 42: 2706-15 (1999)


Article DOI: 10.1021/jm991029k
BindingDB Entry DOI: 10.7270/Q2P55MPV
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50079181
PNG
(1-(1-Benzyl-piperidin-4-yl)-3,5-dimethyl-4-phenyl-...)
Show SMILES Cc1c(-c2ccccc2)n(C)c(=O)n1C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C23H27N3O/c1-18-22(20-11-7-4-8-12-20)24(2)23(27)26(18)21-13-15-25(16-14-21)17-19-9-5-3-6-10-19/h3-12,21H,13-17H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
140n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Affinity to displace [3H]-spiperone from cloned human Dopamine receptor D3 (hD3) stably expressed in HEK-393 cell lines


J Med Chem 42: 2706-15 (1999)


Article DOI: 10.1021/jm991029k
BindingDB Entry DOI: 10.7270/Q2P55MPV
More data for this
Ligand-Target Pair