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BDBM50246315 (R)-2-(3-(2-amino-2-oxoethyl)-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-N-(3-methyl-2,5-dioxo-1',3'-dihydrospiro[imidazolidine-4,2'-indene]-5'-yl)acetamide::CHEMBL521076

SMILES: CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4ccccc4n(CC(N)=O)c3=O)cc2C1

InChI Key: InChIKey=LWPGIBBVQYJCSQ-HSZRJFAPSA-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 = 50246315   
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))
BDBM50246315
PNG
((R)-2-(3-(2-amino-2-oxoethyl)-2-oxo-2,3-dihydro-1H...)
Show SMILES CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4ccccc4n(CC(N)=O)c3=O)cc2C1 |r|
Show InChI InChI=1S/C23H22N6O5/c1-27-21(33)26-20(32)23(27)9-13-6-7-15(8-14(13)10-23)25-19(31)12-29-17-5-3-2-4-16(17)28(22(29)34)11-18(24)30/h2-8H,9-12H2,1H3,(H2,24,30)(H,25,31)(H,26,32,33)/t23-/m1/s1
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PC sid
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Article
PubMed
37n/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
Calcitonin gene-related peptide type 1 receptor


(Homo sapiens (Human))
BDBM50246315
PNG
((R)-2-(3-(2-amino-2-oxoethyl)-2-oxo-2,3-dihydro-1H...)
Show SMILES CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4ccccc4n(CC(N)=O)c3=O)cc2C1 |r|
Show InChI InChI=1S/C23H22N6O5/c1-27-21(33)26-20(32)23(27)9-13-6-7-15(8-14(13)10-23)25-19(31)12-29-17-5-3-2-4-16(17)28(22(29)34)11-18(24)30/h2-8H,9-12H2,1H3,(H2,24,30)(H,25,31)(H,26,32,33)/t23-/m1/s1
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antibodypedia
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PC cid
PC sid
UniChem

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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


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
Calcitonin gene-related peptide type 1 receptor


(Homo sapiens (Human))
BDBM50246315
PNG
((R)-2-(3-(2-amino-2-oxoethyl)-2-oxo-2,3-dihydro-1H...)
Show SMILES CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4ccccc4n(CC(N)=O)c3=O)cc2C1 |r|
Show InChI InChI=1S/C23H22N6O5/c1-27-21(33)26-20(32)23(27)9-13-6-7-15(8-14(13)10-23)25-19(31)12-29-17-5-3-2-4-16(17)28(22(29)34)11-18(24)30/h2-8H,9-12H2,1H3,(H2,24,30)(H,25,31)(H,26,32,33)/t23-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 130n/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