3R14S-Ochratoxin A

3R14S-Ochratoxin A

SCHEMBL5110182

CC1Cc2c(Cl)cc(C(=O)NC(Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 2/20 1.00
GAA P10253 2/20 1.00
ALDH1A1 P00352 2/20 1.00
HPGD P15428 1/20 1.00
ABCC2 Q92887 1/20 1.00
MAOA P21397 2/20 0.45
MAOB P27338 1/20 0.44
KMT2A Q03164 2/20 0.44
FTO Q9C0B1 2/20 0.42
ITGB1 P05556 4/20 0.42
ITGA4 P13612 4/20 0.42
ITGB7 P26010 4/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SCN3A Q9NY46 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
FPR2 P25090 1/20 0.41
ERAP1 Q9NZ08 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
3R14R-Ochratoxin A SCHEMBL29619841 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2
3S14S-Ochratoxin A SCHEMBL28965861 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2
3R14S-Ochratoxin A SCHEMBL28965854 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2
3R14S-Ochratoxin A SCHEMBL29356553 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2
3R14S-Ochratoxin A SCHEMBL29652682 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2
3R14S-Ochratoxin A SCHEMBL29619820 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2
3R14S-Ochratoxin A SCHEMBL24813913 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2
3R14S-Ochratoxin A SCHEMBL28723046 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2
3R14S-Ochratoxin A SCHEMBL29619856 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2
3S14R-Ochratoxin A SCHEMBL28965853 1.00 GLA (1.00) GLAGAAALDH1A1HPGDABCC2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118067892-A Ochratoxin detection method based on PS/PES-CuNPs nanofiber 南京林业大学 2024-05-24 CN disclosed
US-20240067950-A1 MEANS AND METHODS FOR DETOXIFYING OCHRATOXIN A DSM Austria GmbH (AT) 2024-02-29 US disclosed
CN-116334046-A Tool and method for detoxication of ochratoxin a 帝斯曼奥地利有限公司 2023-06-27 CN disclosed
CN-114645037-A Means and methods for detoxification of ochratoxin A 艾尔柏股份公司 2022-06-21 CN disclosed
CN-114292828-A Tetrameric alpha/beta hydrolase variants with improved temperature stability and methods of use and production thereof 爱尔伯股份公司 2022-04-08 CN disclosed
CN-113000033-A Amino surface modification purification membrane material and preparation method and application thereof 中国农业科学院农业质量标准与检测技术研究所 2021-06-22 CN disclosed
CN-110117641-B Method for detecting ochratoxin A by using fluorescence anisotropy technology 中国科学院生态环境研究中心 2021-02-09 CN disclosed
WO-2020132459-A1 QUINOLINYL-PYRAZINE-CARBOXAMIDE COMPOUNDS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-06-25 WO disclosed
CN-110117641-A A method of ochratoxin A is detected using fluorescence anisotropy technology 中国科学院生态环境研究中心 2019-08-13 CN disclosed
US-20080226601-A1 Herpes Virus-Based Compositions and Methods of Use in the Prenatal and Perinatal Periods UNIVERSITY OF ROCHESTER (US) 2008-09-18 US disclosed