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BDBM50166020 CHEMBL190821::Naphthalene-2-carboxylic acid {1-[2-((R)-8-methoxy-1,2,4,4a,5,6-hexahydro-pyrazino[1,2-a]quinolin-3-yl)-ethyl]-piperidin-4-yl}-amide

SMILES: COc1ccc2N3CCN(CCN4CCC(CC4)NC(=O)c4ccc5ccccc5c4)C[C@H]3CCc2c1

InChI Key: InChIKey=DVXDATODDZJCOX-MUUNZHRXSA-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 = 50166020   
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
Dopamine receptor


(Rattus norvegicus (Rat))
BDBM50166020
PNG
(CHEMBL190821 | Naphthalene-2-carboxylic acid {1-[2...)
Show SMILES COc1ccc2N3CCN(CCN4CCC(CC4)NC(=O)c4ccc5ccccc5c4)C[C@H]3CCc2c1
Show InChI InChI=1S/C31H38N4O2/c1-37-29-10-11-30-25(21-29)8-9-28-22-34(18-19-35(28)30)17-16-33-14-12-27(13-15-33)32-31(36)26-7-6-23-4-2-3-5-24(23)20-26/h2-7,10-11,20-21,27-28H,8-9,12-19,22H2,1H3,(H,32,36)/t28-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.64E+3n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibition of [3H]-PD 128907 binding to Dopamine receptor D3 in rat ventral striatum


J Med Chem 48: 3171-81 (2005)


Article DOI: 10.1021/jm049031l
BindingDB Entry DOI: 10.7270/Q2NZ874W
More data for this
Ligand-Target Pair
Dopamine receptor


(RAT)
BDBM50166020
PNG
(CHEMBL190821 | Naphthalene-2-carboxylic acid {1-[2...)
Show SMILES COc1ccc2N3CCN(CCN4CCC(CC4)NC(=O)c4ccc5ccccc5c4)C[C@H]3CCc2c1
Show InChI InChI=1S/C31H38N4O2/c1-37-29-10-11-30-25(21-29)8-9-28-22-34(18-19-35(28)30)17-16-33-14-12-27(13-15-33)32-31(36)26-7-6-23-4-2-3-5-24(23)20-26/h2-7,10-11,20-21,27-28H,8-9,12-19,22H2,1H3,(H,32,36)/t28-/m1/s1
Reactome pathway

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>5.00E+4n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibition of [3H]-Spiperone binding to Dopamine receptor D2-like in rat caudate-putamen membrane


J Med Chem 48: 3171-81 (2005)


Article DOI: 10.1021/jm049031l
BindingDB Entry DOI: 10.7270/Q2NZ874W
More data for this
Ligand-Target Pair
Dopamine D1B


(RAT)
BDBM50166020
PNG
(CHEMBL190821 | Naphthalene-2-carboxylic acid {1-[2...)
Show SMILES COc1ccc2N3CCN(CCN4CCC(CC4)NC(=O)c4ccc5ccccc5c4)C[C@H]3CCc2c1
Show InChI InChI=1S/C31H38N4O2/c1-37-29-10-11-30-25(21-29)8-9-28-22-34(18-19-35(28)30)17-16-33-14-12-27(13-15-33)32-31(36)26-7-6-23-4-2-3-5-24(23)20-26/h2-7,10-11,20-21,27-28H,8-9,12-19,22H2,1H3,(H,32,36)/t28-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH- 23390 binding to Dopamine receptor D1-like in rat brain


J Med Chem 48: 3171-81 (2005)


Article DOI: 10.1021/jm049031l
BindingDB Entry DOI: 10.7270/Q2NZ874W
More data for this
Ligand-Target Pair