BindingDB logo
myBDB logout

BDBM50455940 CHEMBL8250

SMILES: Cn1cc(C2=NCC3(CCN4CCCC3C4)O2)c2ccccc12

InChI Key: InChIKey=FSAPAZYAWGKWEB-UHFFFAOYSA-N

Data: 1 IC50

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 = 50455940   
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
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)		BDBM50455940
PNG
(CHEMBL8250)
Show SMILES Cn1cc(C2=NCC3(CCN4CCCC3C4)O2)c2ccccc12 |t:4,TLB:16:7:15:11.13.12,THB:6:7:15:11.13.12|
Show InChI InChI=1S/C19H23N3O/c1-21-12-16(15-6-2-3-7-17(15)21)18-20-13-19(23-18)8-10-22-9-4-5-14(19)11-22/h2-3,6-7,12,14H,4-5,8-11,13H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 1.10n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Compound was evaluated for the displacement of [3H]Q-ICS-205-930 from 5-HT3 recognition sites in rat brain membranes

J Med Chem 35: 1019-31 (1992)


BindingDB Entry DOI: 10.7270/Q2833THX
More data for this
Ligand-Target Pair