BindingDB logo
myBDB logout

BDBM50444824 CHEMBL3099232

SMILES: CCCN1C[C@H](Cn2ccc(n2)-c2ccccc2)O[C@@H]2Cc3c(O)cccc3C[C@@H]12

InChI Key: InChIKey=PYQMFEXIFSASPF-QFZRFWILSA-N

Data: 1 EC50

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 1 hit for monomerid = 50444824   
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(2) dopamine receptor


(Homo sapiens (Human))
BDBM50444824
PNG
(CHEMBL3099232)
Show SMILES CCCN1C[C@H](Cn2ccc(n2)-c2ccccc2)O[C@@H]2Cc3c(O)cccc3C[C@@H]12 |r|
Show InChI InChI=1S/C25H29N3O2/c1-2-12-27-16-20(17-28-13-11-22(26-28)18-7-4-3-5-8-18)30-25-15-21-19(14-23(25)27)9-6-10-24(21)29/h3-11,13,20,23,25,29H,2,12,14-17H2,1H3/t20-,23-,25-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 13n/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Agonist activity at human dopamine D2 receptor expressed in CHO cells assessed as increase of forskolin-induced cAMP production after 20 mins


Bioorg Med Chem 22: 381-92 (2013)


Article DOI: 10.1016/j.bmc.2013.11.012
BindingDB Entry DOI: 10.7270/Q26T0P3C
More data for this
Ligand-Target Pair