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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gonadotropin-releasing hormone receptor' and Ligand = 'BDBM50109260'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))		BDBM50109260
PNG
(6-[(Benzyl-methyl-amino)-methyl]-7-(4-butyrylamino...)
Show SMILES CCCC(=O)Nc1ccc(cc1)-c1cc2n(Cc3ccccc3F)cc(C(=O)NCCCc3ccccc3)c(=O)n2c1CN(C)Cc1ccccc1
Show InChI InChI=1S/C43H44FN5O3/c1-3-13-40(50)46-35-23-21-33(22-24-35)36-26-41-48(28-34-19-10-11-20-38(34)44)29-37(42(51)45-25-12-18-31-14-6-4-7-15-31)43(52)49(41)39(36)30-47(2)27-32-16-8-5-9-17-32/h4-11,14-17,19-24,26,29H,3,12-13,18,25,27-28,30H2,1-2H3,(H,45,51)(H,46,50)
PDB

KEGG

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PC cid
PC sid
UniChem

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



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human gonadotropin-releasing hormone (hGnRH) receptor expressed in HEK293 cells using des-Gly10[125I-Tyr,5DLeu,6NMeLeu,7Pro9-NEt]...

Bioorg Med Chem Lett 12: 403-6 (2002)


BindingDB Entry DOI: 10.7270/Q2542MXV
More data for this
Ligand-Target Pair