BindingDB logo
myBDB logout

BDBM50246271 (R)-methyl 2-(5,7-dimethyl-3-(2-(3-methyl-2,5-dioxo-1',3'-dihydrospiro[imidazolidine-4,2'-indene]-5'-ylamino)-2-oxoethyl)-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate::CHEMBL488082

SMILES: COC(=O)Cn1c2c(C)cc(C)cc2n(CC(=O)Nc2ccc3C[C@]4(Cc3c2)N(C)C(=O)NC4=O)c1=O

InChI Key: InChIKey=DVWHBSJZSHVOSH-AREMUKBSSA-N

Data: 1 KI  2 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 3 hits for monomerid = 50246271   
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
CGRP type 1 receptor


(Homo sapiens (Human))
BDBM50246271
PNG
((R)-methyl 2-(5,7-dimethyl-3-(2-(3-methyl-2,5-diox...)
Show SMILES COC(=O)Cn1c2c(C)cc(C)cc2n(CC(=O)Nc2ccc3C[C@]4(Cc3c2)N(C)C(=O)NC4=O)c1=O |r|
Show InChI InChI=1S/C26H27N5O6/c1-14-7-15(2)22-19(8-14)30(25(36)31(22)13-21(33)37-4)12-20(32)27-18-6-5-16-10-26(11-17(16)9-18)23(34)28-24(35)29(26)3/h5-9H,10-13H2,1-4H3,(H,27,32)(H,28,34,35)/t26-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.10n/an/an/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Displacement of [125I]hCGRP from human cloned CGRP receptor expressed in HEK93 cells


Bioorg Med Chem Lett 18: 6122-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.019
BindingDB Entry DOI: 10.7270/Q24Q7TTF
More data for this
Ligand-Target Pair
CGRP type 1 receptor


(Homo sapiens (Human))
BDBM50246271
PNG
((R)-methyl 2-(5,7-dimethyl-3-(2-(3-methyl-2,5-diox...)
Show SMILES COC(=O)Cn1c2c(C)cc(C)cc2n(CC(=O)Nc2ccc3C[C@]4(Cc3c2)N(C)C(=O)NC4=O)c1=O |r|
Show InChI InChI=1S/C26H27N5O6/c1-14-7-15(2)22-19(8-14)30(25(36)31(22)13-21(33)37-4)12-20(32)27-18-6-5-16-10-26(11-17(16)9-18)23(34)28-24(35)29(26)3/h5-9H,10-13H2,1-4H3,(H,27,32)(H,28,34,35)/t26-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.60n/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Antagonist activity against human cloned CGRP receptor expressed in HEK93 cells assessed as inhibition of CGRP-induced cAMP production


Bioorg Med Chem Lett 18: 6122-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.019
BindingDB Entry DOI: 10.7270/Q24Q7TTF
More data for this
Ligand-Target Pair
CGRP type 1 receptor


(Homo sapiens (Human))
BDBM50246271
PNG
((R)-methyl 2-(5,7-dimethyl-3-(2-(3-methyl-2,5-diox...)
Show SMILES COC(=O)Cn1c2c(C)cc(C)cc2n(CC(=O)Nc2ccc3C[C@]4(Cc3c2)N(C)C(=O)NC4=O)c1=O |r|
Show InChI InChI=1S/C26H27N5O6/c1-14-7-15(2)22-19(8-14)30(25(36)31(22)13-21(33)37-4)12-20(32)27-18-6-5-16-10-26(11-17(16)9-18)23(34)28-24(35)29(26)3/h5-9H,10-13H2,1-4H3,(H,27,32)(H,28,34,35)/t26-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 150n/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Antagonist activity against human cloned CGRP receptor expressed in HEK93 cells assessed as inhibition of CGRP-induced cAMP production in presence of...


Bioorg Med Chem Lett 18: 6122-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.019
BindingDB Entry DOI: 10.7270/Q24Q7TTF
More data for this
Ligand-Target Pair