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BDBM62221 2-(4,6-dimethylisoxazolo[5,4-b]pyridin-3-yl)oxy-1-[3-methyl-4-(m-tolyl)piperazino]ethanone::2-[(4,6-dimethyl-3-isoxazolo[5,4-b]pyridinyl)oxy]-1-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]ethanone::2-[(4,6-dimethyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)oxy]-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]ethanone::KUC103676N::cid_44473132

SMILES: CC1CN(CCN1c1cccc(C)c1)C(=O)COc1noc2nc(C)cc(C)c12

InChI Key: InChIKey=BKCAQRNMUSHHJI-UHFFFAOYSA-N

Data: 4 EC50

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 = 62221   
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
regulator of G-protein signaling 4


(Homo sapiens (Human))
BDBM62221
PNG
(2-(4,6-dimethylisoxazolo[5,4-b]pyridin-3-yl)oxy-1-...)
Show SMILES CC1CN(CCN1c1cccc(C)c1)C(=O)COc1noc2nc(C)cc(C)c12
Show InChI InChI=1S/C22H26N4O3/c1-14-6-5-7-18(10-14)26-9-8-25(12-17(26)4)19(27)13-28-22-20-15(2)11-16(3)23-21(20)29-24-22/h5-7,10-11,17H,8-9,12-13H2,1-4H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2CF9NJZ
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 8


(Homo sapiens (Human))
BDBM62221
PNG
(2-(4,6-dimethylisoxazolo[5,4-b]pyridin-3-yl)oxy-1-...)
Show SMILES CC1CN(CCN1c1cccc(C)c1)C(=O)COc1noc2nc(C)cc(C)c12
Show InChI InChI=1S/C22H26N4O3/c1-14-6-5-7-18(10-14)26-9-8-25(12-17(26)4)19(27)13-28-22-20-15(2)11-16(3)23-21(20)29-24-22/h5-7,10-11,17H,8-9,12-13H2,1-4H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2M043TQ
More data for this
Ligand-Target Pair
regulator of G-protein signalling 16


(Homo sapiens (Human))
BDBM62221
PNG
(2-(4,6-dimethylisoxazolo[5,4-b]pyridin-3-yl)oxy-1-...)
Show SMILES CC1CN(CCN1c1cccc(C)c1)C(=O)COc1noc2nc(C)cc(C)c12
Show InChI InChI=1S/C22H26N4O3/c1-14-6-5-7-18(10-14)26-9-8-25(12-17(26)4)19(27)13-28-22-20-15(2)11-16(3)23-21(20)29-24-22/h5-7,10-11,17H,8-9,12-13H2,1-4H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2VH5M8G
More data for this
Ligand-Target Pair
RGS7


(Homo sapiens (Human))
BDBM62221
PNG
(2-(4,6-dimethylisoxazolo[5,4-b]pyridin-3-yl)oxy-1-...)
Show SMILES CC1CN(CCN1c1cccc(C)c1)C(=O)COc1noc2nc(C)cc(C)c12
Show InChI InChI=1S/C22H26N4O3/c1-14-6-5-7-18(10-14)26-9-8-25(12-17(26)4)19(27)13-28-22-20-15(2)11-16(3)23-21(20)29-24-22/h5-7,10-11,17H,8-9,12-13H2,1-4H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2416VG3
More data for this
Ligand-Target Pair