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BDBM50099826 4-Bromo-1-methoxy-naphthalene-2-carboxylic acid (1-cyclohexyl-pyrrolidin-3-yl)-amide::CHEMBL54026

SMILES: COc1c(cc(Br)c2ccccc12)C(=O)N[C@@H]1CCN(C1)C1CCCCC1

InChI Key: InChIKey=UWMANVFYGMUYDW-OAHLLOKOSA-N

Data: 3 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50099826   
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
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50099826
PNG
(4-Bromo-1-methoxy-naphthalene-2-carboxylic acid (1...)
Show SMILES COc1c(cc(Br)c2ccccc12)C(=O)N[C@@H]1CCN(C1)C1CCCCC1
Show InChI InChI=1S/C22H27BrN2O2/c1-27-21-18-10-6-5-9-17(18)20(23)13-19(21)22(26)24-15-11-12-25(14-15)16-7-3-2-4-8-16/h5-6,9-10,13,15-16H,2-4,7-8,11-12,14H2,1H3,(H,24,26)/t15-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.20n/an/an/an/an/an/an/an/a



Wake Forest University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity for sigma-1 receptor measured on guinea pig brain membranes using [3H]-(+)-pentazocine as radioligand.


J Med Chem 44: 1815-26 (2001)


BindingDB Entry DOI: 10.7270/Q2NK3DBZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Rattus norvegicus (Rat))
BDBM50099826
PNG
(4-Bromo-1-methoxy-naphthalene-2-carboxylic acid (1...)
Show SMILES COc1c(cc(Br)c2ccccc12)C(=O)N[C@@H]1CCN(C1)C1CCCCC1
Show InChI InChI=1S/C22H27BrN2O2/c1-27-21-18-10-6-5-9-17(18)20(23)13-19(21)22(26)24-15-11-12-25(14-15)16-7-3-2-4-8-16/h5-6,9-10,13,15-16H,2-4,7-8,11-12,14H2,1H3,(H,24,26)/t15-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
5.70n/an/an/an/an/an/an/an/a



Wake Forest University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D3 expressed in Sf9 cells using [125I]-IABN the radioligand.


J Med Chem 44: 1815-26 (2001)


BindingDB Entry DOI: 10.7270/Q2NK3DBZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50099826
PNG
(4-Bromo-1-methoxy-naphthalene-2-carboxylic acid (1...)
Show SMILES COc1c(cc(Br)c2ccccc12)C(=O)N[C@@H]1CCN(C1)C1CCCCC1
Show InChI InChI=1S/C22H27BrN2O2/c1-27-21-18-10-6-5-9-17(18)20(23)13-19(21)22(26)24-15-11-12-25(14-15)16-7-3-2-4-8-16/h5-6,9-10,13,15-16H,2-4,7-8,11-12,14H2,1H3,(H,24,26)/t15-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
74n/an/an/an/an/an/an/an/a



Wake Forest University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 long expressed in Sf9 cells using [125I]-IABN radioligand.


J Med Chem 44: 1815-26 (2001)


BindingDB Entry DOI: 10.7270/Q2NK3DBZ
More data for this
Ligand-Target Pair