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BDBM39736 1'-butyl-2'-spiro[1,2-dihydro-4,1,2-benzoxadiazine-3,3'-indole]one::1'-butylspiro[1,2-dihydro-4,1,2-benzoxadiazine-3,3'-indole]-2'-one::1'-butylspiro[1,2-dihydro-4,1,2-benzoxadiazine-3,3'-indoline]-2'-one::MLS000565241::SMR000152508::cid_4588070

SMILES: CCCCN1C(=O)C2(NNc3ccccc3O2)c2ccccc12

InChI Key: InChIKey=GIARZSALMUOKQS-UHFFFAOYSA-N

Data: 1 IC50  2 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 3 hits for monomerid = 39736   
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
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM39736
PNG
(1'-butyl-2'-spiro[1,2-dihydro-4,1,2-benzoxadiazine...)
Show SMILES CCCCN1C(=O)C2(NNc3ccccc3O2)c2ccccc12
Show InChI InChI=1S/C18H19N3O2/c1-2-3-12-21-15-10-6-4-8-13(15)18(17(21)22)20-19-14-9-5-7-11-16(14)23-18/h4-11,19-20H,2-3,12H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.99E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2MS3R5M
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM39736
PNG
(1'-butyl-2'-spiro[1,2-dihydro-4,1,2-benzoxadiazine...)
Show SMILES CCCCN1C(=O)C2(NNc3ccccc3O2)c2ccccc12
Show InChI InChI=1S/C18H19N3O2/c1-2-3-12-21-15-10-6-4-8-13(15)18(17(21)22)20-19-14-9-5-7-11-16(14)23-18/h4-11,19-20H,2-3,12H2,1H3
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 195n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2N58JTN
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM39736
PNG
(1'-butyl-2'-spiro[1,2-dihydro-4,1,2-benzoxadiazine...)
Show SMILES CCCCN1C(=O)C2(NNc3ccccc3O2)c2ccccc12
Show InChI InChI=1S/C18H19N3O2/c1-2-3-12-21-15-10-6-4-8-13(15)18(17(21)22)20-19-14-9-5-7-11-16(14)23-18/h4-11,19-20H,2-3,12H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 9.99E+5n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair