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BDBM38945 2-thenyl(thieno[2,3-d]pyrimidin-4-yl)amine::MLS000055859::N-(thiophen-2-ylmethyl)-4-thieno[2,3-d]pyrimidinamine::N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine::SMR000064548::cid_2525677

SMILES: C(Nc1ncnc2sccc12)c1cccs1

InChI Key: InChIKey=FHVNZFNXRNPLKU-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 = 38945   
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
Nuclear receptor ROR-alpha


(Homo sapiens (Human))
BDBM38945
PNG
(2-thenyl(thieno[2,3-d]pyrimidin-4-yl)amine | MLS00...)
Show SMILES C(Nc1ncnc2sccc12)c1cccs1
Show InChI InChI=1S/C11H9N3S2/c1-2-8(15-4-1)6-12-10-9-3-5-16-11(9)14-7-13-10/h1-5,7H,6H2,(H,12,13,14)
PDB
MMDB

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PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.68E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q26Q1VNZ
More data for this
Ligand-Target Pair
heat shock protein 90


(Candida albicans)
BDBM38945
PNG
(2-thenyl(thieno[2,3-d]pyrimidin-4-yl)amine | MLS00...)
Show SMILES C(Nc1ncnc2sccc12)c1cccs1
Show InChI InChI=1S/C11H9N3S2/c1-2-8(15-4-1)6-12-10-9-3-5-16-11(9)14-7-13-10/h1-5,7H,6H2,(H,12,13,14)
PDB
MMDB

UniProtKB/TrEMBL

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UniChem

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PCBioAssay
n/an/an/an/a 1.76E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q26M358G
More data for this
Ligand-Target Pair
Steroidogenic Factor 1


(Homo sapiens (Human))
BDBM38945
PNG
(2-thenyl(thieno[2,3-d]pyrimidin-4-yl)amine | MLS00...)
Show SMILES C(Nc1ncnc2sccc12)c1cccs1
Show InChI InChI=1S/C11H9N3S2/c1-2-8(15-4-1)6-12-10-9-3-5-16-11(9)14-7-13-10/h1-5,7H,6H2,(H,12,13,14)
PDB
MMDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
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Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.49E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2319T8T
More data for this
Ligand-Target Pair