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BDBM51298 4-[5-[(E)-(5-azanylidene-7-oxidanylidene-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoic acid::4-[5-[(E)-(5-imino-7-keto-3-phenyl-thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]-2-furyl]benzoic acid::4-[5-[(E)-(5-imino-7-oxo-3-phenyl-6-thiazolo[3,2-a]pyrimidinylidene)methyl]-2-furanyl]benzoic acid::4-[5-[(E)-(5-imino-7-oxo-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoic acid::4-{5-[5-Imino-7-oxo-3-phenyl-7H-thiazolo[3,2-a]pyrimidin-(6E)-ylidenemethyl]-furan-2-yl}-benzoic acid::MLS000777068::SMR000413460::cid_1921349

SMILES: OC(=O)c1ccc(cc1)-c1ccc(\C=C2\C(=O)N=C3SC=C(N3C2=N)c2ccccc2)o1

InChI Key: InChIKey=PGHQBHPIVJYUDE-SCORJZKRSA-N

Data: 3 IC50

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 = 51298   
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
BZLF2


(Human herpesvirus 4 type 2)
BDBM51298
PNG
(4-[5-[(E)-(5-azanylidene-7-oxidanylidene-3-phenyl-...)
Show SMILES OC(=O)c1ccc(cc1)-c1ccc(\C=C2\C(=O)N=C3SC=C(N3C2=N)c2ccccc2)o1 |c:21,t:18|
Show InChI InChI=1S/C24H15N3O4S/c25-21-18(12-17-10-11-20(31-17)15-6-8-16(9-7-15)23(29)30)22(28)26-24-27(21)19(13-32-24)14-4-2-1-3-5-14/h1-13,25H,(H,29,30)/b18-12+,25-21?
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.24E+3n/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: Theodore Jardetzky; Northw...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2057DCW
More data for this
Ligand-Target Pair
Voltage-gated calcium channel subunit alpha Cav2.2


(Homo sapiens (Human))
BDBM51298
PNG
(4-[5-[(E)-(5-azanylidene-7-oxidanylidene-3-phenyl-...)
Show SMILES OC(=O)c1ccc(cc1)-c1ccc(\C=C2\C(=O)N=C3SC=C(N3C2=N)c2ccccc2)o1 |c:21,t:18|
Show InChI InChI=1S/C24H15N3O4S/c25-21-18(12-17-10-11-20(31-17)15-6-8-16(9-7-15)23(29)30)22(28)26-24-27(21)19(13-32-24)14-4-2-1-3-5-14/h1-13,25H,(H,29,30)/b18-12+,25-21?
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a 4.12E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute Network...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2PZ578V
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM51298
PNG
(4-[5-[(E)-(5-azanylidene-7-oxidanylidene-3-phenyl-...)
Show SMILES OC(=O)c1ccc(cc1)-c1ccc(\C=C2\C(=O)N=C3SC=C(N3C2=N)c2ccccc2)o1 |c:21,t:18|
Show InChI InChI=1S/C24H15N3O4S/c25-21-18(12-17-10-11-20(31-17)15-6-8-16(9-7-15)23(29)30)22(28)26-24-27(21)19(13-32-24)14-4-2-1-3-5-14/h1-13,25H,(H,29,30)/b18-12+,25-21?
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.92E+4n/an/an/an/an/an/a



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/Q20P0XFH
More data for this
Ligand-Target Pair