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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Calcitonin gene-related peptide (CGRP alpha)' and Ligand = 'BDBM126183'   
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
Calcitonin gene-related peptide (CGRP alpha)


(Homo sapiens (Human))
BDBM126183
PNG
(US8778957, 7)
Show SMILES CN1C(=O)NC(=O)C11Cc2cc3ccc(CN4CCC(Cc5ccccc5)CC4)nc3cc2C1
Show InChI InChI=1S/C28H30N4O2/c1-31-27(34)30-26(33)28(31)16-22-14-21-7-8-24(29-25(21)15-23(22)17-28)18-32-11-9-20(10-12-32)13-19-5-3-2-4-6-19/h2-8,14-15,20H,9-13,16-18H2,1H3,(H,30,33,34)
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PC cid
PC sid
UniChem
US Patent
3.80E+3 -30.9n/an/an/an/an/a7.425



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Cells expressing recombinant human CL receptor/RAMP1 were washed with PBS and harvested in harvest buffer containing 50 mM HEPES, 1 mM EDTA and Compl...


US Patent US8778957 (2014)


BindingDB Entry DOI: 10.7270/Q29022G8
More data for this
Ligand-Target Pair