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 | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 5/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CETP | P11597 | 3/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | THRA | P10827 | 1/20 | 0.44 |
| ▸ | PLA2G2D | Q9UNK4 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL8095916 | 1.00 | HCAR2 (0.57) | HCAR2ALDH1A1LMNAL3MBTL1KDM4E | |
| Acrylic Acid SCHEMBL8102270 | 0.95 | TSHR (0.54) | HCAR2ALDH1A1LMNAL3MBTL1KDM4E | |
| SCHEMBL11662783 | 0.95 | TSHR (0.57) | HCAR2ALDH1A1LMNAL3MBTL1MAPT | |
| SCHEMBL8418367 | 0.95 | TSHR (0.57) | HCAR2ALDH1A1LMNAL3MBTL1MAPT | |
| SCHEMBL8102267 | 0.91 | HCAR2 (0.50) | HCAR2ALDH1A1LMNAL3MBTL1KDM4E | |
| Methacrylic Acid SCHEMBL8096653 | 0.89 | TSHR (0.50) | HCAR2ALDH1A1LMNAL3MBTL1MAPT | |
| SCHEMBL5654912 | 0.87 | HCAR2 (0.62) | HCAR2ALDH1A1LMNAL3MBTL1KDM4E | |
| SCHEMBL28545362 | 0.86 | TSHR (0.56) | HCAR2ALDH1A1LMNAL3MBTL1TSHR | |
| Styrene SCHEMBL8094673 | 0.86 | HCAR2 (0.58) | HCAR2ALDH1A1LMNAL3MBTL1KDM4E | |
| Styrene SCHEMBL8094670 | 0.86 | HCAR2 (0.58) | HCAR2ALDH1A1LMNAL3MBTL1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5886065-A | WATERFASTNESS, NON-FLOCCULATING | HEWLETT-PACKARD COMPANY (US) | 1999-03-23 | — | — | US | claimed |
| US-6034153-A | STABLE COLORANT | HEWLETT-PACKARD COMPANY (US) | 2000-03-07 | — | — | US | disclosed |
| US-5886065-A | WATERFASTNESS, NON-FLOCCULATING | HEWLETT-PACKARD COMPANY (US) | 1999-03-23 | — | — | US | disclosed |