ZINC
12
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ZINC ID or SMILES
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Identity
99%
90%
80%
70%
Substructure
2-methylenecoumaran-3-one
PubMed
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SMILES:
Ring Information
Rings
Ring Systems
Atoms
Carbons
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Oxygens
Sulfurs
2
1
11
9
0
2
0
Subset Information
Substances
Natural
Purchasable
Annotated
BB
In Man
Last Updated
View
4,035
5,927
5
14
0
2012-03-07
Parents (
2 Total
)
Benzene
2-methylenefuran-3-one
Children (
216 Total
)
2-cyclopentylidenecoumaran-3-one
2-(2-furfurylidene)coumaran-3-one
2-(2-thenylidene)coumaran-3-one
2-(3-thenylidene)coumaran-3-one
2-(2-pyridylmethylene)coumaran-3…
2-(3-pyridylmethylene)coumaran-3…
2-(4-pyridylmethylene)coumaran-3…
2-methylene-7-(pyrrolidinomethyl…
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
Description
Size
Browse
Download
(Annotations)
MTOR_HUMAN
P42345
CHEMBL2842
FK506 Binding Protein 12, Human
3
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
MTOR_HUMAN
P42345
CHEMBL2842
FK506 Binding Protein 12, Human
3
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
PK3CA_HUMAN
P42336
CHEMBL4005
PI3-kinase P110-alpha Subunit, Human
3
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
PK3CA_HUMAN
P42336
CHEMBL4005
PI3-kinase P110-alpha Subunit, Human
3
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z81170
Z81170
CHEMBL612518
LNCaP (Prostate Carcinoma)
2
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
PK3CG_HUMAN
P48736
CHEMBL3267
PI3-kinase P110-gamma Subunit, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
PK3CG_HUMAN
P48736
CHEMBL3267
PI3-kinase P110-gamma Subunit, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z80054
Z80054
CHEMBL614058
Caco-2 (Colon Adenocarcinoma Cells)
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z80211
Z80211
CHEMBL614721
LoVo (Colon Adenocarcinoma Cells)
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z80390
Z80390
CHEMBL390
PC-3 (Prostate Carcinoma Cells)
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z80418
Z80418
CHEMBL612557
RAW264.7 (Monocytic-macrophage Leukemia Cells)
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z81057
Z81057
CHEMBL613979
HUVEC (Umbilical Vein Endothelial Cells)
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase