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BDBM50120778 CHEMBL3618347

SMILES: COc1cc(ccc1OCC(O)C1CC1)-n1cnn2cc(cc2c1=O)-c1ncc(Cl)cn1

InChI Key: InChIKey=YJRQMEMJIWBDAJ-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 = 50120778   
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
GPR24


(RAT)
BDBM50120778
PNG
(CHEMBL3618347)
Show SMILES COc1cc(ccc1OCC(O)C1CC1)-n1cnn2cc(cc2c1=O)-c1ncc(Cl)cn1
Show InChI InChI=1S/C22H20ClN5O4/c1-31-20-7-16(4-5-19(20)32-11-18(29)13-2-3-13)27-12-26-28-10-14(6-17(28)22(27)30)21-24-8-15(23)9-25-21/h4-10,12-13,18,29H,2-3,11H2,1H3
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
15n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Displacement of [125I][Phe13,Tyr19]-MCH from rat MCHR1 by scintillation counting analysis


Bioorg Med Chem Lett 25: 4412-8 (2015)


BindingDB Entry DOI: 10.7270/Q2JD4ZMW
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (Human))
BDBM50120778
PNG
(CHEMBL3618347)
Show SMILES COc1cc(ccc1OCC(O)C1CC1)-n1cnn2cc(cc2c1=O)-c1ncc(Cl)cn1
Show InChI InChI=1S/C22H20ClN5O4/c1-31-20-7-16(4-5-19(20)32-11-18(29)13-2-3-13)27-12-26-28-10-14(6-17(28)22(27)30)21-24-8-15(23)9-25-21/h4-10,12-13,18,29H,2-3,11H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
17n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Displacement of [125I][Phe13,Tyr19]-MCH from human MCHR1 expressed in HEK293 cells by scintillation counting analysis


Bioorg Med Chem Lett 25: 4412-8 (2015)


BindingDB Entry DOI: 10.7270/Q2JD4ZMW
More data for this
Ligand-Target Pair