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BDBM258764 US9499482, 164

SMILES: CCc1cc(ccc1OCCN1CCCC1)N1CC=C(Oc2ccc(cc2)C2CC2)C1=O

InChI Key: InChIKey=HDMPXTPQWDZYGR-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 258764   
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
Melanin-concentrating hormone receptor 1 (MCHR1)(E4Q)(A5T)


(Homo sapiens (Human))
BDBM258764
PNG
(US9499482, 164)
Show SMILES CCc1cc(ccc1OCCN1CCCC1)N1CC=C(Oc2ccc(cc2)C2CC2)C1=O
Show InChI InChI=1S/C27H32N2O3/c1-2-20-19-23(9-12-25(20)31-18-17-28-14-3-4-15-28)29-16-13-26(27(29)30)32-24-10-7-22(8-11-24)21-5-6-21/h7-13,19,21H,2-6,14-18H2,1H3
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
0.5n/an/an/an/an/an/a7.4n/a



Bristol-Myers Squibb Company

US Patent


Assay Description
An in vitro binding assay was used to determine the compound Ki value or ability to antagonize binding of a peptide agonist to the human melanin conc...


US Patent US9499482 (2016)


BindingDB Entry DOI: 10.7270/Q2M907KT
More data for this
Ligand-Target Pair