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BDBM50186835 4'-[6-(2-diethylamino-ethyl)-1-(5-fluoro-6-trifluoromethyl-1H-benzoimidazol-2-yl)-6-aza-spiro[2.5]oct-1-yl]-biphenyl-3-carbonitrile::CHEMBL209754

SMILES: CCN(CC)CCN1CCC2(CC2(c2nc3cc(c(F)cc3[nH]2)C(F)(F)F)c2ccc(cc2)-c2cccc(c2)C#N)CC1

InChI Key: InChIKey=HTKIJSNZEHJCRA-UHFFFAOYSA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50186835   
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


(Homo sapiens (Human))		BDBM50186835
PNG
(4'-[6-(2-diethylamino-ethyl)-1-(5-fluoro-6-trifluo...)
Show SMILES CCN(CC)CCN1CCC2(CC2(c2nc3cc(c(F)cc3[nH]2)C(F)(F)F)c2ccc(cc2)-c2cccc(c2)C#N)CC1
Show InChI InChI=1S/C34H35F4N5/c1-3-42(4-2)16-17-43-14-12-32(13-15-43)22-33(32,26-10-8-24(9-11-26)25-7-5-6-23(18-25)21-39)31-40-29-19-27(34(36,37)38)28(35)20-30(29)41-31/h5-11,18-20H,3-4,12-17,22H2,1-2H3,(H,40,41)
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Article
PubMed
 15n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to human MCHR1 assessed as inhibition of MCH-mediated calcium ion influx by FLIPR assay

Bioorg Med Chem Lett 16: 3674-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.062
BindingDB Entry DOI: 10.7270/Q2XG9QQB
More data for this
Ligand-Target Pair