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BDBM258758 US9499482, 157

SMILES: COc1cc(ccc1OCCN1CC(O)(C1)C1CC1)N1CCC(Oc2ccc(cc2)C2CC2)C1=O

InChI Key: InChIKey=PYMHMSXDLPHJMT-UHFFFAOYSA-N

Data: 1 KI

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   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 = 258758   
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))
BDBM258758
PNG
(US9499482, 157)
Show SMILES COc1cc(ccc1OCCN1CC(O)(C1)C1CC1)N1CCC(Oc2ccc(cc2)C2CC2)C1=O
Show InChI InChI=1S/C28H34N2O5/c1-33-26-16-22(8-11-24(26)34-15-14-29-17-28(32,18-29)21-6-7-21)30-13-12-25(27(30)31)35-23-9-4-20(5-10-23)19-2-3-19/h4-5,8-11,16,19,21,25,32H,2-3,6-7,12-15,17-18H2,1H3
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
0.400n/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