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ZINC ID or SMILES
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Identity
99%
90%
80%
70%
Substructure
Xanthone
PubMed
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SMILES:
Ring Information
Rings
Ring Systems
Atoms
Carbons
Nitrogens
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3
1
15
13
0
2
0
Subset Information
Substances
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Annotated
BB
In Man
Last Updated
View
10
5
9
1
1
2012-03-07
Parents (
2 Total
)
Benzene
Pyran-4-one
Children (
9 Total
)
2-(2-pyrrolidin-2-ylethylamino)x…
3-(2-pyrrolidin-2-ylethylamino)x…
3-(2-cyclohexylethynyl)xanthone
9-keto-N-(1H-tetrazol-5-yl)xanth…
2-(3-imidazol-1-ylpropylamino)xa…
3-(3-imidazol-1-ylpropylamino)xa…
3-(3-morpholinopropylamino)xanthone
N-(1,1-diketothiolan-3-yl)-2-(9-…
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
Description
Size
Browse
Download
(Annotations)
Z50426
Z50426
CHEMBL612856
Plasmodium Falciparum (isolate K1 / Thailand)
3
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
NANH_CLOPE
P10481
CHEMBL5189
Sialidase, Clope
2
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
NANH_CLOPE
P10481
CHEMBL5189
Sialidase, Clope
2
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z102352
Z102352
CHEMBL613652
Plasma
2
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z80493
Z80493
CHEMBL614925
SK-OV-3 (Ovarian Carcinoma Cells)
2
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z80682
Z80682
CHEMBL392
A549 (Lung Carcinoma Cells)
2
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
AOFA_HUMAN
P21397
CHEMBL1951
Monoamine Oxidase A, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
ESR1_HUMAN
P03372
CHEMBL206
Estrogen Receptor Alpha, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
ESR2_HUMAN
Q92731
CHEMBL242
Estrogen Receptor Beta, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
LT4R1_HUMAN
Q15722
CHEMBL3911
Leukotriene B4 Receptor 1, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
LT4R1_HUMAN
Q15722
CHEMBL3911
Leukotriene B4 Receptor 1, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
LT4R1_HUMAN
Q15722
CHEMBL3911
Leukotriene B4 Receptor 1, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
Z50587
Z50587
CHEMBL372
Homo Sapiens
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase