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BDBM50224438 4-(2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-1-yl)-N-[(3R)-2-oxo-6-pyridin-3-ylazepan-3-yl]piperidine-1-carboxamide::CHEMBL240685

SMILES: O=C(N[C@@H]1CCC(CNC1=O)c1cccnc1)N1CCC(CC1)n1c2cccnc2[nH]c1=O

InChI Key: InChIKey=GGUVJLLXBQWSCH-UHUGOGIASA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50224438   
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))
BDBM50224438
PNG
(4-(2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-1-yl...)
Show SMILES O=C(N[C@@H]1CCC(CNC1=O)c1cccnc1)N1CCC(CC1)n1c2cccnc2[nH]c1=O
Show InChI InChI=1S/C23H27N7O3/c31-21-18(6-5-16(14-26-21)15-3-1-9-24-13-15)27-22(32)29-11-7-17(8-12-29)30-19-4-2-10-25-20(19)28-23(30)33/h1-4,9-10,13,16-18H,5-8,11-12,14H2,(H,26,31)(H,27,32)(H,25,28,33)/t16?,18-/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
9.90E+3n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]CGPR from human CL receptor expressed in HEK293 cells


J Med Chem 50: 5564-7 (2007)


Article DOI: 10.1021/jm070668p
BindingDB Entry DOI: 10.7270/Q28C9W02
More data for this
Ligand-Target Pair