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BDBM50090576 7-Chloro-3-indan-5-yl-2-oxo-4-((S)-2-piperidin-2-yl-ethoxy)-1,2-dihydro-quinoline-6-carboxylic acid pyrimidin-4-ylamide::CHEMBL48674

SMILES: Clc1cc2[nH]c(=O)c(-c3ccc4CCCc4c3)c(OCC[C@@H]3CCCCN3)c2cc1C(=O)Nc1ccncn1

InChI Key: InChIKey=LDPBFWKHHOZVLX-NRFANRHFSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50090576   
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 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50090576
PNG
(7-Chloro-3-indan-5-yl-2-oxo-4-((S)-2-piperidin-2-y...)
Show SMILES Clc1cc2[nH]c(=O)c(-c3ccc4CCCc4c3)c(OCC[C@@H]3CCCCN3)c2cc1C(=O)Nc1ccncn1
Show InChI InChI=1S/C30H30ClN5O3/c31-24-16-25-23(15-22(24)29(37)36-26-9-12-32-17-34-26)28(39-13-10-21-6-1-2-11-33-21)27(30(38)35-25)20-8-7-18-4-3-5-19(18)14-20/h7-9,12,14-17,21,33H,1-6,10-11,13H2,(H,35,38)(H,32,34,36,37)/t21-/m0/s1
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 0.700n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of recombinant human Gonadotropin-releasing hormone receptor


Bioorg Med Chem Lett 10: 1723-7 (2000)


Article DOI: 10.1016/s0960-894x(00)00318-8
BindingDB Entry DOI: 10.7270/Q26W99B2
More data for this
Ligand-Target Pair