Maleic Acid

Maleic Acid

SCHEMBL27464322

O=C(O)/C=C\C(=O)O.c1cnnnc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol

The experimentally established mechanism targets of Maleic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.33
TSHR P16473 2/20 0.50
TP53 P04637 1/20 0.50
EGLN1 Q9GZT9 1/20 0.50
EGLN3 Q9H6Z9 1/20 0.50
ALDH1A1 P00352 6/20 0.37
KDM4E B2RXH2 4/20 0.37
HCAR2 Q8TDS4 3/20 0.37
HDAC3 O15379 1/20 0.37
TNKS O95271 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HDAC9 Q9UKV0 1/20 0.37

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
Fumaric Acid SCHEMBL10917587 1.00 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
SCHEMBL28001554 0.89 TSHR (0.39) TSHRTP53EGLN1EGLN3ALDH1A1
Maleic Acid SCHEMBL3709578 0.86 TSHR (0.53) TSHRTP53EGLN1EGLN3ALDH1A1
Fumaric Acid SCHEMBL3661879 0.86 TSHR (0.53) TSHRTP53EGLN1EGLN3ALDH1A1
Fumaric Acid SCHEMBL3661882 0.86 TSHR (0.53) TSHRTP53EGLN1EGLN3ALDH1A1
Bicarbonate SCHEMBL9005252 0.82 CA1 (0.36) HCAR2KMT2AMEN1LMNA
Acrylic Acid SCHEMBL1191355 0.81 LMNA (0.53) TSHRALDH1A1LMNA
Bicarbonate SCHEMBL29455645 0.79 CA1 (0.33)
Hydrogen Peroxide SCHEMBL27500303 0.78
Maleic Acid SCHEMBL27583410 0.78 TSHR (0.82) TSHRTP53EGLN1EGLN3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106187928-B A kind of preparation method of irsogladine maleate 安徽省逸欣铭医药科技有限公司 2019-06-07 CN disclosed
CN-106187928-A A kind of preparation method of irsogladine maleate 安徽省逸欣铭医药科技有限公司 2016-12-07 CN disclosed
CN-1270403-C Circuit board device and its manufacturing mehtod SONY CORP (JP) 2006-08-16 CN disclosed
CN-1491448-A Circuit board device and its manufacturing mehtod ���ṫ˾ 2004-04-21 CN disclosed
CN-1155244-A Triazine derivative and medicine NIPPON SHINYAKU CO LTD (JP) 1997-07-23 CN disclosed