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BDBM39611 1-(2-keto-2-pyrrolidino-ethyl)-3-phenyl-thieno[3,2-d]pyrimidine-2,4-quinone::1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-3-phenyl-thieno[3,2-d]pyrimidine-2,4-dione::1-(2-oxo-2-pyrrolidin-1-ylethyl)-3-phenylthieno[3,2-d]pyrimidine-2,4(1H,3H)-dione::1-(2-oxo-2-pyrrolidin-1-ylethyl)-3-phenylthieno[3,2-d]pyrimidine-2,4-dione::1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-phenylthieno[3,2-d]pyrimidine-2,4-dione::MLS000087515::SMR000023738::cid_3236980

SMILES: O=C(Cn1c2ccsc2c(=O)n(-c2ccccc2)c1=O)N1CCCC1

InChI Key: InChIKey=HFAHKHKXCYGZLJ-UHFFFAOYSA-N

Data: 2 IC50  1 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 = 39611   
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, germ cell type


(Homo sapiens (Human))
BDBM39611
PNG
(1-(2-keto-2-pyrrolidino-ethyl)-3-phenyl-thieno[3,2...)
Show SMILES O=C(Cn1c2ccsc2c(=O)n(-c2ccccc2)c1=O)N1CCCC1
Show InChI InChI=1S/C18H17N3O3S/c22-15(19-9-4-5-10-19)12-20-14-8-11-25-16(14)17(23)21(18(20)24)13-6-2-1-3-7-13/h1-3,6-8,11H,4-5,9-10,12H2
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, germ cell type


(Homo sapiens (Human))
BDBM39611
PNG
(1-(2-keto-2-pyrrolidino-ethyl)-3-phenyl-thieno[3,2...)
Show SMILES O=C(Cn1c2ccsc2c(=O)n(-c2ccccc2)c1=O)N1CCCC1
Show InChI InChI=1S/C18H17N3O3S/c22-15(19-9-4-5-10-19)12-20-14-8-11-25-16(14)17(23)21(18(20)24)13-6-2-1-3-7-13/h1-3,6-8,11H,4-5,9-10,12H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 2.65E+3n/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
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM39611
PNG
(1-(2-keto-2-pyrrolidino-ethyl)-3-phenyl-thieno[3,2...)
Show SMILES O=C(Cn1c2ccsc2c(=O)n(-c2ccccc2)c1=O)N1CCCC1
Show InChI InChI=1S/C18H17N3O3S/c22-15(19-9-4-5-10-19)12-20-14-8-11-25-16(14)17(23)21(18(20)24)13-6-2-1-3-7-13/h1-3,6-8,11H,4-5,9-10,12H2
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.16E+4n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q23X8539
More data for this
Ligand-Target Pair