Aristolochic Acid C

Aristolochic Acid C

SCHEMBL30697302

O=C(O)c1cc2c(c3c1c([N+](=O)[O-])cc1ccc(O)cc13)OCO2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 7/20 1.00
MEN1 O00255 5/20 0.60
KMT2A Q03164 5/20 0.60
MAPT P10636 4/20 0.60
ALDH1A1 P00352 3/20 0.60
CYP3A4 P08684 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
TXNRD1 Q16881 1/20 0.37
TXNRD3 Q86VQ6 1/20 0.37
TXNRD2 Q9NNW7 1/20 0.37
TDP1 Q9NUW8 2/20 0.35
RAB9A P51151 2/20 0.35
PTPN1 P18031 1/20 0.35
HNF4A P41235 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 1/20 0.34
PABPC1 P11940 1/20 0.34
EIF4H Q15056 1/20 0.34
XDH P47989 1/20 0.33
SLC22A12 Q96S37 1/20 0.33

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
Aristolochic Acid C SCHEMBL30039516 1.00 CDK2 (1.00) CDK2MEN1KMT2AMAPTALDH1A1
Aristolochic Acid Ii SCHEMBL29518307 0.87 CDK2 (0.77) CDK2MEN1KMT2AMAPTALDH1A1
Aristolochic Acid Ii SCHEMBL571697 0.87 CDK2 (0.77) CDK2MEN1KMT2AMAPTALDH1A1
Aristolochic Acid Iii SCHEMBL30568104 0.80 CDK2 (1.00) CDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL7456768 0.79 CDK2 (0.68) CDK2MEN1KMT2AMAPTALDH1A1
Aristolochic D SCHEMBL26801941 0.79 CDK2 (1.00) CDK2MEN1KMT2AMAPTALDH1A1
Aristolochic D SCHEMBL29588367 0.79 CDK2 (1.00) CDK2MEN1KMT2AMAPTALDH1A1
7-Hydroxy Aristolochic A SCHEMBL4557492 0.76 CDK2 (1.00) CDK2MEN1KMT2AMAPTALDH1A1
Aristolochic Acid SCHEMBL166284 0.75 ALDH1A1 (1.00) CDK2MEN1KMT2AMAPTALDH1A1
Aristolochic Acid SCHEMBL29518476 0.75 ALDH1A1 (1.00) CDK2MEN1KMT2AMAPTALDH1A1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117471003-B Separation and quantitative detection method for aristolochic acid component in houttuynia cordata and application thereof 中国中医科学院中药研究所 2024-10-08 CN claimed
CN-117517537-B Method for detecting aristolochic acid in Baicao oil based on elimination of matrix effect 山东省食品药品检验研究院 2024-09-17 CN claimed
CN-117805273-B Quantitative detection method and application of 5 aristolochic acid substances in diarrhea-relieving capsule 浙江苏可安药业有限公司 2024-06-14 CN claimed
CN-117805273-A Quantitative detection method and application of 5 aristolochic acid substances in diarrhea-relieving capsule 浙江苏可安药业有限公司 2024-04-02 CN claimed
CN-117517537-A Method for detecting aristolochic acid in Baicao oil based on elimination of matrix effect 山东省食品药品检验研究院 2024-02-06 CN claimed
CN-117471003-A Separation and quantitative detection method for aristolochic acid component in houttuynia cordata and application thereof 中国中医科学院中药研究所 2024-01-30 CN claimed
CN-117471003-B Separation and quantitative detection method for aristolochic acid component in houttuynia cordata and application thereof 中国中医科学院中药研究所 2024-10-08 CN disclosed
CN-117517537-B Method for detecting aristolochic acid in Baicao oil based on elimination of matrix effect 山东省食品药品检验研究院 2024-09-17 CN disclosed
CN-117517537-B Method for detecting aristolochic acid in Baicao oil based on elimination of matrix effect 山东省食品药品检验研究院 2024-09-17 CN disclosed
CN-117805273-B Quantitative detection method and application of 5 aristolochic acid substances in diarrhea-relieving capsule 浙江苏可安药业有限公司 2024-06-14 CN disclosed
CN-117805273-A Quantitative detection method and application of 5 aristolochic acid substances in diarrhea-relieving capsule 浙江苏可安药业有限公司 2024-04-02 CN disclosed
CN-117517537-A Method for detecting aristolochic acid in Baicao oil based on elimination of matrix effect 山东省食品药品检验研究院 2024-02-06 CN disclosed
CN-117517537-A Method for detecting aristolochic acid in Baicao oil based on elimination of matrix effect 山东省食品药品检验研究院 2024-02-06 CN disclosed
CN-117471003-A Separation and quantitative detection method for aristolochic acid component in houttuynia cordata and application thereof 中国中医科学院中药研究所 2024-01-30 CN disclosed