BindingDB logo
myBDB logout

BDBM50231307 CHEMBL34622

SMILES: CCC(=O)NCCc1c[nH]c2ccc(OC)cc12

InChI Key: InChIKey=VXGNHTKZJOTYNZ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50231307   
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
Melatonin receptor type 1C


(Gallus gallus)
BDBM50231307
PNG
(CHEMBL34622)
Show SMILES CCC(=O)NCCc1c[nH]c2ccc(OC)cc12
Show InChI InChI=1S/C14H18N2O2/c1-3-14(17)15-7-6-10-9-16-13-5-4-11(18-2)8-12(10)13/h4-5,8-9,16H,3,6-7H2,1-2H3,(H,15,17)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
0.190n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
Binding affinity towards melatonin receptor in chicken brain.


J Med Chem 39: 1797-805 (1996)

More data for this
Ligand-Target Pair
Melatonin receptor


(Gallus gallus-Chick)
BDBM50231307
PNG
(CHEMBL34622)
Show SMILES CCC(=O)NCCc1c[nH]c2ccc(OC)cc12
Show InChI InChI=1S/C14H18N2O2/c1-3-14(17)15-7-6-10-9-16-13-5-4-11(18-2)8-12(10)13/h4-5,8-9,16H,3,6-7H2,1-2H3,(H,15,17)
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
0.270n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair