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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 362180   
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 type 1 receptor


(Homo sapiens (Human))
BDBM362180
PNG
(US10272077, Example 8 from US 2010/0179166 | US983...)
Show SMILES CC(C)(O)CN1C[C@@H](CC[C@@H](NC(=O)c2ccc3CC4(Cc3c2)C(=O)Nc2ncccc42)C1=O)c1cccc(F)c1F |r|
Show InChI InChI=1S/C32H32F2N4O4/c1-31(2,42)17-38-16-20(22-5-3-7-24(33)26(22)34)10-11-25(29(38)40)36-28(39)18-8-9-19-14-32(15-21(19)13-18)23-6-4-12-35-27(23)37-30(32)41/h3-9,12-13,20,25,42H,10-11,14-17H2,1-2H3,(H,36,39)(H,35,37,41)/t20-,25-,32?/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
1.70n/an/an/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The binding of 125I-CGRP to receptors in SK-N-MC cell membranes was carried out essentially as described (Edvinsson et al. (2001) Eur. J. Pharmacol. ...


J Med Chem 51: 5663-79 (2008)


BindingDB Entry DOI: 10.7270/Q25X2C8C
More data for this
Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor


(Homo sapiens (Human))
BDBM362180
PNG
(US10272077, Example 8 from US 2010/0179166 | US983...)
Show SMILES CC(C)(O)CN1C[C@@H](CC[C@@H](NC(=O)c2ccc3CC4(Cc3c2)C(=O)Nc2ncccc42)C1=O)c1cccc(F)c1F |r|
Show InChI InChI=1S/C32H32F2N4O4/c1-31(2,42)17-38-16-20(22-5-3-7-24(33)26(22)34)10-11-25(29(38)40)36-28(39)18-8-9-19-14-32(15-21(19)13-18)23-6-4-12-35-27(23)37-30(32)41/h3-9,12-13,20,25,42H,10-11,14-17H2,1-2H3,(H,36,39)(H,35,37,41)/t20-,25-,32?/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
1.70n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Cells were resuspended in DMEM/F12 (Hyclone) supplemented with 1 g/L BSA and 300 μM isobutyl-methylxanthine. Cells were then plated in a 384-wel...


US Patent US9833448 (2017)


BindingDB Entry DOI: 10.7270/Q2BP052K
More data for this
Ligand-Target Pair