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BDBM50052862 1-((R)-11-Methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-yl)-ethanone::CHEMBL324372

SMILES: COc1c(ccc2C[C@H]3N(C)CCc4cccc(c34)-c12)C(C)=O

InChI Key: InChIKey=RXDUVKIICDGRRM-QGZVFWFLSA-N

Data: 3 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 3 hits for monomerid = 50052862   
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
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50052862
PNG
(1-((R)-11-Methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-...)
Show SMILES COc1c(ccc2C[C@H]3N(C)CCc4cccc(c34)-c12)C(C)=O
Show InChI InChI=1S/C20H21NO2/c1-12(22)15-8-7-14-11-17-18-13(9-10-21(17)2)5-4-6-16(18)19(14)20(15)23-3/h4-8,17H,9-11H2,1-3H3/t17-/m1/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
150n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
In vitro affinity at 5-hydroxytryptamine 1A receptor of rat hippocampus by [3H]-8-OH-DPAT displacement.


J Med Chem 39: 3491-502 (1996)


Article DOI: 10.1021/jm960188q
BindingDB Entry DOI: 10.7270/Q2XW4HXS
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50052862
PNG
(1-((R)-11-Methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-...)
Show SMILES COc1c(ccc2C[C@H]3N(C)CCc4cccc(c34)-c12)C(C)=O
Show InChI InChI=1S/C20H21NO2/c1-12(22)15-8-7-14-11-17-18-13(9-10-21(17)2)5-4-6-16(18)19(14)20(15)23-3/h4-8,17H,9-11H2,1-3H3/t17-/m1/s1
PDB

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PC cid
PC sid
UniChem

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Article
PubMed
2.98E+3n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
In vitro affinity at human cloned Dopamine receptor D2A by [3H]-raclopride displacement.


J Med Chem 39: 3491-502 (1996)


Article DOI: 10.1021/jm960188q
BindingDB Entry DOI: 10.7270/Q2XW4HXS
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50052862
PNG
(1-((R)-11-Methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-...)
Show SMILES COc1c(ccc2C[C@H]3N(C)CCc4cccc(c34)-c12)C(C)=O
Show InChI InChI=1S/C20H21NO2/c1-12(22)15-8-7-14-11-17-18-13(9-10-21(17)2)5-4-6-16(18)19(14)20(15)23-3/h4-8,17H,9-11H2,1-3H3/t17-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.82E+3n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
In vitro affinity at Dopamine receptor D1 of rat striatum by [3H]-SCH-23,390 displacement.


J Med Chem 39: 3491-502 (1996)


Article DOI: 10.1021/jm960188q
BindingDB Entry DOI: 10.7270/Q2XW4HXS
More data for this
Ligand-Target Pair