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BDBM93951 3-(5,7-dimethyl-2-phenyl-6-pyrazolo[1,5-a]pyrimidinyl)-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-propanone::3-(5,7-dimethyl-2-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propan-1-one::3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propan-1-one::8-[3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanoyl]-1,4-dioxa-8-azaspiro[4.5]decane::MLS000089605::SMR000027953::cid_3241529

SMILES: Cc1nc2cc(nn2c(C)c1CCC(=O)N1CCC2(CC1)OCCO2)-c1ccccc1

InChI Key: InChIKey=ZIRPLSMLJTVITL-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 93951   
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
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))
BDBM93951
PNG
(3-(5,7-dimethyl-2-phenyl-6-pyrazolo[1,5-a]pyrimidi...)
Show SMILES Cc1nc2cc(nn2c(C)c1CCC(=O)N1CCC2(CC1)OCCO2)-c1ccccc1
Show InChI InChI=1S/C24H28N4O3/c1-17-20(8-9-23(29)27-12-10-24(11-13-27)30-14-15-31-24)18(2)28-22(25-17)16-21(26-28)19-6-4-3-5-7-19/h3-7,16H,8-15H2,1-2H3
PDB
MMDB

Reactome pathway
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antibodypedia
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 832n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2WS8RVZ
More data for this
Ligand-Target Pair