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BDBM50059499 3-(4-Chloro-benzyl)-8-methyl-1,2,3,4-tetrahydro-chromeno[3,4-c]pyridin-5-one::CHEMBL89921

SMILES: Cc1ccc2c3CCN(Cc4ccc(Cl)cc4)Cc3c(=O)oc2c1

InChI Key: InChIKey=MCJPCWOSNLXXLG-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50059499   
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))
BDBM50059499
PNG
(3-(4-Chloro-benzyl)-8-methyl-1,2,3,4-tetrahydro-ch...)
Show SMILES Cc1ccc2c3CCN(Cc4ccc(Cl)cc4)Cc3c(=O)oc2c1
Show InChI InChI=1S/C20H18ClNO2/c1-13-2-7-17-16-8-9-22(11-14-3-5-15(21)6-4-14)12-18(16)20(23)24-19(17)10-13/h2-7,10H,8-9,11-12H2,1H3
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
11n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Ability to displace [3H]-spiperone from cloned human Dopamine receptor D4 expressed in CHO K-1 cells in vitro


J Med Chem 40: 2688-93 (1997)


Article DOI: 10.1021/jm970170v
BindingDB Entry DOI: 10.7270/Q2SF2V8X
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50059499
PNG
(3-(4-Chloro-benzyl)-8-methyl-1,2,3,4-tetrahydro-ch...)
Show SMILES Cc1ccc2c3CCN(Cc4ccc(Cl)cc4)Cc3c(=O)oc2c1
Show InChI InChI=1S/C20H18ClNO2/c1-13-2-7-17-16-8-9-22(11-14-3-5-15(21)6-4-14)12-18(16)20(23)24-19(17)10-13/h2-7,10H,8-9,11-12H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.17E+3n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Ability to displace [3H]-spiperone from human cloned Dopamine receptor D2 expressed in CHO K-1 cells in vitro.


J Med Chem 40: 2688-93 (1997)


Article DOI: 10.1021/jm970170v
BindingDB Entry DOI: 10.7270/Q2SF2V8X
More data for this
Ligand-Target Pair