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BDBM50121474 5-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydro-naphthalen-2-ylmethyl)-furan-2-carboxylic acid 4-[(5-trifluoromethyl-pyrimidin-2-ylamino)-methyl]-benzylamide::CHEMBL122653

SMILES: Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3nccc(n3)C(F)(F)F)c1)C(C)(C)CCC2(C)C

InChI Key: InChIKey=TYZQNLSBMJCSLZ-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50121474   
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
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))		BDBM50121474
PNG
(5-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydro-naphth...)
Show SMILES Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCc1cccc(CNc3nccc(n3)C(F)(F)F)c1)C(C)(C)CCC2(C)C
Show InChI InChI=1S/C34H37F3N4O2/c1-21-15-26-27(33(4,5)13-12-32(26,2)3)18-24(21)17-25-9-10-28(43-25)30(42)39-19-22-7-6-8-23(16-22)20-40-31-38-14-11-29(41-31)34(35,36)37/h6-11,14-16,18H,12-13,17,19-20H2,1-5H3,(H,39,42)(H,38,40,41)
PDB

KEGG

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PC cid
PC sid
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Patents

Similars
PubMed
 780n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development-La Jolla/Agouron Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human gonadotropin-releasing hormone receptor

Bioorg Med Chem Lett 12: 3635-9 (2002)


BindingDB Entry DOI: 10.7270/Q2XK8DXZ
More data for this
Ligand-Target Pair