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BDBM50373786 CHEMBL255966

SMILES: FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1

InChI Key: InChIKey=PAVNCDNTAVTPEH-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50373786   
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))
BDBM50373786
PNG
(CHEMBL255966)
Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1
Show InChI InChI=1S/C25H23F3N6O3/c26-25(27,28)15-33-14-17(16-5-2-1-3-6-16)13-19(22(33)35)30-23(36)32-11-8-18(9-12-32)34-20-7-4-10-29-21(20)31-24(34)37/h1-7,10,13-14,18H,8-9,11-12,15H2,(H,30,36)(H,29,31,37)
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
95n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1


Bioorg Med Chem Lett 18: 755-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2
More data for this
Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor


(Homo sapiens (Human))
BDBM50373786
PNG
(CHEMBL255966)
Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1
Show InChI InChI=1S/C25H23F3N6O3/c26-25(27,28)15-33-14-17(16-5-2-1-3-6-16)13-19(22(33)35)30-23(36)32-11-8-18(9-12-32)34-20-7-4-10-29-21(20)31-24(34)37/h1-7,10,13-14,18H,8-9,11-12,15H2,(H,30,36)(H,29,31,37)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 209n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay


Bioorg Med Chem Lett 18: 755-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2
More data for this
Ligand-Target Pair