Known targets — ChEMBL curated mechanism
ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol
The experimentally established mechanism targets of Fumaric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 SCHEMBL10536991 | 1.00 | TSHR (0.39) | TSHRTP53EGLN1EGLN3GAA | |
| Fumaric Acid SCHEMBL10537007 | 1.00 | TSHR (0.39) | TSHRTP53EGLN1EGLN3GAA | |
| SCHEMBL10887043 | 0.91 | TSHR (0.32) | TSHRTP53EGLN1EGLN3 | |
| Bicarbonate SCHEMBL2130736 | 0.86 | — | — | |
| Acrylic Acid SCHEMBL381788 | 0.85 | LMNA (0.42) | — | |
| SCHEMBL14938709 | 0.82 | — | — | |
| Carbamic Acid SCHEMBL27869277 | 0.82 | ACHE (0.33) | — | |
| Acetic Acid SCHEMBL27129104 | 0.82 | FFAR3 (0.33) | — | |
| Bicarbonate SCHEMBL28099591 | 0.82 | — | — | |
| SCHEMBL9421394 | 0.81 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1080138-B1 | PLASMA SURFACE TREATMENT OF SILICONE HYDROGEL CONTACT LENSES | BAUSCH & LOMB (US) | 2002-08-28 | — | — | EP | disclosed |
| EP-1080138-A1 | PLASMA SURFACE TREATMENT OF SILICONE HYDROGEL CONTACT LENSES | BAUSCH & LOMB INCORPORATED (US) | 2001-03-07 | — | — | EP | disclosed |
| EP-1080139-A1 | PLASMA SURFACE TREATMENT OF SILICONE HYDROGEL CONTACT LENSES | BAUSCH & LOMB INCORPORATED (US) | 2001-03-07 | — | — | EP | disclosed |
| US-6193369-B1 | Plasma surface treatment of silicone hydrogel contact lenses | BAUSCH & LOMB INCORPORATED | 2001-02-27 | — | — | US | disclosed |
| WO-1999057177-A1 | PLASMA SURFACE TREATMENT OF SILICONE HYDROGEL CONTACT LENSES | BAUSCH & LOMB INCORPORATED (US) | 1999-11-11 | — | — | WO | disclosed |
| WO-1999057178-A1 | PLASMA SURFACE TREATMENT OF SILICONE HYDROGEL CONTACT LENSES | BAUSCH & LOMB INCORPORATED (US) | 1999-11-11 | — | — | WO | disclosed |