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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Calcitonin gene-related peptide type 1 receptor/Receptor activity-modifying protein 1' and Ligand = 'BDBM50217489'   
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/Receptor activity-modifying protein 1


(Homo sapiens (Human))
BDBM50217489
PNG
((R)-N-(1-(cyclopropylmethyl)-2-oxoazepan-3-yl)-4-(...)
Show SMILES O=C(N[C@@H]1CCCCN(CC2CC2)C1=O)N1CCC(CC1)N1Cc2ccccc2NC1=O
Show InChI InChI=1S/C24H33N5O3/c30-22-21(7-3-4-12-28(22)15-17-8-9-17)26-23(31)27-13-10-19(11-14-27)29-16-18-5-1-2-6-20(18)25-24(29)32/h1-2,5-6,17,19,21H,3-4,7-16H2,(H,25,32)(H,26,31)/t21-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
7.80E+3n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]CGRP from human CL receptor in RAMP1 membranes


Bioorg Med Chem Lett 17: 4795-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.062
BindingDB Entry DOI: 10.7270/Q2JS9Q4D
More data for this
Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor/Receptor activity-modifying protein 1


(Homo sapiens (Human))
BDBM50217489
PNG
((R)-N-(1-(cyclopropylmethyl)-2-oxoazepan-3-yl)-4-(...)
Show SMILES O=C(N[C@@H]1CCCCN(CC2CC2)C1=O)N1CCC(CC1)N1Cc2ccccc2NC1=O
Show InChI InChI=1S/C24H33N5O3/c30-22-21(7-3-4-12-28(22)15-17-8-9-17)26-23(31)27-13-10-19(11-14-27)29-16-18-5-1-2-6-20(18)25-24(29)32/h1-2,5-6,17,19,21H,3-4,7-16H2,(H,25,32)(H,26,31)/t21-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.40E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human CGRP receptor in E10 cells assessed as inhibition of cAMP production


Bioorg Med Chem Lett 17: 4795-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.062
BindingDB Entry DOI: 10.7270/Q2JS9Q4D
More data for this
Ligand-Target Pair