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BDBM50184072 (R)-4-(2-oxo-1,2,4,5-tetrahydrobenzo[d][1,3]diazepin-3-yl)-N-(2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)piperidine-1-carboxamide::CHEMBL381710

SMILES: FC(F)(F)CN1c2ccccc2C(=N[C@@H](NC(=O)N2CCC(CC2)N2CCc3ccccc3NC2=O)C1=O)c1ccccc1

InChI Key: InChIKey=DPKUUAZWPCGLJU-NDEPHWFRSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50184072   
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/Receptor activity-modifying protein 1


(Homo sapiens (Human))
BDBM50184072
PNG
((R)-4-(2-oxo-1,2,4,5-tetrahydrobenzo[d][1,3]diazep...)
Show SMILES FC(F)(F)CN1c2ccccc2C(=N[C@@H](NC(=O)N2CCC(CC2)N2CCc3ccccc3NC2=O)C1=O)c1ccccc1 |c:13|
Show InChI InChI=1S/C32H31F3N6O3/c33-32(34,35)20-41-26-13-7-5-11-24(26)27(22-9-2-1-3-10-22)37-28(29(41)42)38-30(43)39-17-15-23(16-18-39)40-19-14-21-8-4-6-12-25(21)36-31(40)44/h1-13,23,28H,14-20H2,(H,36,44)(H,38,43)/t28-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
61n/an/an/an/an/an/an/an/a



Department of Medicinal Chemistry Merck & Co.

Curated by ChEMBL


Assay Description
Displacement of [125I]CGRP from human cloned CLR/RAMP1 receptor expressed in E10 cells


Bioorg Med Chem Lett 16: 2595-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.02.051
BindingDB Entry DOI: 10.7270/Q2HT2NX8
More data for this
Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor/Receptor activity-modifying protein 1


(Homo sapiens (Human))
BDBM50184072
PNG
((R)-4-(2-oxo-1,2,4,5-tetrahydrobenzo[d][1,3]diazep...)
Show SMILES FC(F)(F)CN1c2ccccc2C(=N[C@@H](NC(=O)N2CCC(CC2)N2CCc3ccccc3NC2=O)C1=O)c1ccccc1 |c:13|
Show InChI InChI=1S/C32H31F3N6O3/c33-32(34,35)20-41-26-13-7-5-11-24(26)27(22-9-2-1-3-10-22)37-28(29(41)42)38-30(43)39-17-15-23(16-18-39)40-19-14-21-8-4-6-12-25(21)36-31(40)44/h1-13,23,28H,14-20H2,(H,36,44)(H,38,43)/t28-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 43n/an/an/an/an/an/a



Department of Medicinal Chemistry Merck & Co.

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned CLR/RAMP1 receptor expressed in E10 cells measured as inhibition of CGRP-mediated cAMP production


Bioorg Med Chem Lett 16: 2595-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.02.051
BindingDB Entry DOI: 10.7270/Q2HT2NX8
More data for this
Ligand-Target Pair