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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | PDE4A | P27815 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.50 |
| ▸ | RARB | P10826 | 3/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.47 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.47 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL7740814 | 0.93 | L3MBTL1 (0.48) | TP53TSHRCYP2D6 | |
| SCHEMBL6407420 | 0.88 | MMP1 (0.56) | MMP1TP53TSHRPLA2G4BKDM4E | |
| SCHEMBL8718224 | 0.85 | TP53 (0.57) | MMP1TP53TSHRPLA2G4BRARB | |
| SCHEMBL15020066 | 0.84 | TP53 (0.59) | TP53TSHRPLA2G4BCYP2D6RARB | |
| SCHEMBL6510086 | 0.84 | TP53 (0.59) | TP53TSHRPLA2G4BCYP2D6RARB | |
| SCHEMBL7341007 | 0.84 | TP53 (0.59) | TP53TSHRPLA2G4BCYP2D6RARB | |
| SCHEMBL3275310 | 0.82 | PLK1 (0.56) | MMP1KDM4ECYP1A2CYP2D6PDE4A | |
| SCHEMBL549185 | 0.80 | TMPRSS2 (0.60) | MMP1CYP2D6 | |
| SCHEMBL548439 | 0.80 | PRSS1 (0.60) | CYP2D6 | |
| Pentamidine Dao SCHEMBL548448 | 0.78 | PRMT1 (0.61) | CYP2D6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0861071-B1 | BENZAMIDOXIME PRODRUGS AND USE THEREOF FOR TREATING PNEUMONIA | UNIV NORTH CAROLINA (US) | 2005-05-11 | — | — | EP | claimed |