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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 = 'BDBM126190'   
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))
BDBM126190
PNG
(US8778957, 45)
Show SMILES O=C1Nc2ncccc2C11Cc2cc3ccc(CN4CCc5c(C4)[nH]c4ccccc54)nc3cc2C1
Show InChI InChI=1S/C30H25N5O/c36-29-30(24-5-3-10-31-28(24)34-29)14-19-12-18-7-8-21(32-26(18)13-20(19)15-30)16-35-11-9-23-22-4-1-2-6-25(22)33-27(23)17-35/h1-8,10,12-13,33H,9,11,14-17H2,(H,31,34,36)
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PC cid
PC sid
UniChem
US Patent
180 -38.5n/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