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BDBM50268483 (R)-1-(4-(4-fluorophenyl)piperazin-1-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-2-yl 4-(2-oxo-1,2-dihydroquinolin-3-yl)piperidine-1-carboxylate::CHEMBL507893

SMILES: Cc1cc(C[C@@H](OC(=O)N2CCC(CC2)c2cc3ccccc3[nH]c2=O)C(=O)N2CCN(CC2)c2ccc(F)cc2)cc2cn[nH]c12

InChI Key: InChIKey=TYCNHYDMTQDAOT-JGCGQSQUSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50268483   
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
Calcitonin gene-related peptide type 1 receptor


(Homo sapiens (Human))
BDBM50268483
PNG
((R)-1-(4-(4-fluorophenyl)piperazin-1-yl)-3-(7-meth...)
Show SMILES Cc1cc(C[C@@H](OC(=O)N2CCC(CC2)c2cc3ccccc3[nH]c2=O)C(=O)N2CCN(CC2)c2ccc(F)cc2)cc2cn[nH]c12 |r|
Show InChI InChI=1S/C36H37FN6O4/c1-23-18-24(19-27-22-38-40-33(23)27)20-32(35(45)42-16-14-41(15-17-42)29-8-6-28(37)7-9-29)47-36(46)43-12-10-25(11-13-43)30-21-26-4-2-3-5-31(26)39-34(30)44/h2-9,18-19,21-22,25,32H,10-17,20H2,1H3,(H,38,40)(H,39,44)/t32-/m1/s1
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MMDB

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Article
PubMed
n/an/a 0.130n/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned CGRP receptor expressed in mouse E10 cells assessed as inhibition of CGRP-induced cAMP production


Bioorg Med Chem Lett 19: 3555-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.150
BindingDB Entry DOI: 10.7270/Q2WM1DBQ
More data for this
Ligand-Target Pair