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BDBM50246228 (R)-N-(3-methyl-2,5-dioxo-1',3'-dihydrospiro[imidazolidine-4,2'-indene]-5'-yl)-2-(3,4,6-trimethyl-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetamide::CHEMBL530116

SMILES: CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4cc(C)cc(C)c4n(C)c3=O)cc2C1

InChI Key: InChIKey=VOVVNUWMTFITFY-XMMPIXPASA-N

Data: 1 KI  3 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 4 hits for monomerid = 50246228   
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))
BDBM50246228
PNG
((R)-N-(3-methyl-2,5-dioxo-1',3'-dihydrospiro[imida...)
Show SMILES CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4cc(C)cc(C)c4n(C)c3=O)cc2C1 |r|
Show InChI InChI=1S/C24H25N5O4/c1-13-7-14(2)20-18(8-13)29(23(33)27(20)3)12-19(30)25-17-6-5-15-10-24(11-16(15)9-17)21(31)26-22(32)28(24)4/h5-9H,10-12H2,1-4H3,(H,25,30)(H,26,31,32)/t24-/m1/s1
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Article
PubMed
2.70n/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))
BDBM50246228
PNG
((R)-N-(3-methyl-2,5-dioxo-1',3'-dihydrospiro[imida...)
Show SMILES CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4cc(C)cc(C)c4n(C)c3=O)cc2C1 |r|
Show InChI InChI=1S/C24H25N5O4/c1-13-7-14(2)20-18(8-13)29(23(33)27(20)3)12-19(30)25-17-6-5-15-10-24(11-16(15)9-17)21(31)26-22(32)28(24)4/h5-9H,10-12H2,1-4H3,(H,25,30)(H,26,31,32)/t24-/m1/s1
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PubMed
n/an/a 370n/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
Calcitonin gene-related peptide type 1 receptor


(Homo sapiens (Human))
BDBM50246228
PNG
((R)-N-(3-methyl-2,5-dioxo-1',3'-dihydrospiro[imida...)
Show SMILES CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4cc(C)cc(C)c4n(C)c3=O)cc2C1 |r|
Show InChI InChI=1S/C24H25N5O4/c1-13-7-14(2)20-18(8-13)29(23(33)27(20)3)12-19(30)25-17-6-5-15-10-24(11-16(15)9-17)21(31)26-22(32)28(24)4/h5-9H,10-12H2,1-4H3,(H,25,30)(H,26,31,32)/t24-/m1/s1
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Article
PubMed
n/an/a 10n/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))
BDBM50246228
PNG
((R)-N-(3-methyl-2,5-dioxo-1',3'-dihydrospiro[imida...)
Show SMILES CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4cc(C)cc(C)c4n(C)c3=O)cc2C1 |r|
Show InChI InChI=1S/C24H25N5O4/c1-13-7-14(2)20-18(8-13)29(23(33)27(20)3)12-19(30)25-17-6-5-15-10-24(11-16(15)9-17)21(31)26-22(32)28(24)4/h5-9H,10-12H2,1-4H3,(H,25,30)(H,26,31,32)/t24-/m1/s1
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Article
PubMed
n/an/a 1.20E+3n/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