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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | EGLN1 | Q9GZT9 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.43 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.43 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SLC13A3 | Q8WWT9 | 1/20 | 0.40 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.40 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.35 |
| ▸ | TET2 | Q6N021 | 3/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | TET3 | O43151 | 1/20 | 0.33 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.33 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL26631 | 0.87 | LMNA (0.56) | ALOX15HSD17B10EGLN1LMNATSHR | |
| SCHEMBL10663570 | 0.87 | LMNA (0.56) | ALOX15HSD17B10EGLN1LMNATSHR | |
| Itaconate SCHEMBL17204479 | 0.86 | ALOX15 (0.65) | ALOX15HSD17B10EGLN1LMNATSHR | |
| Itaconate SCHEMBL17204476 | 0.86 | ALOX15 (0.65) | ALOX15HSD17B10EGLN1LMNATSHR | |
| Acrylic Acid SCHEMBL4893564 | 0.86 | ALOX15 (0.64) | ALOX15HSD17B10EGLN1LMNATSHR | |
| SCHEMBL17178419 | 0.85 | LMNA (0.53) | ALOX15HSD17B10EGLN1LMNATSHR | |
| SCHEMBL20790180 | 0.85 | LMNA (0.53) | ALOX15HSD17B10EGLN1LMNATSHR | |
| SCHEMBL2815799 | 0.85 | LMNA (0.53) | ALOX15HSD17B10EGLN1LMNATSHR | |
| SCHEMBL2816688 | 0.85 | LMNA (0.53) | ALOX15HSD17B10EGLN1LMNATSHR | |
| SCHEMBL20262536 | 0.85 | LMNA (0.53) | ALOX15HSD17B10EGLN1LMNATSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0332326-B1 | POLYURETHANE COATING COMPOSITIONS | ICI RESINS BV (NL) | 1993-03-03 | — | — | EP | disclosed |
| EP-0332326-A2 | Polyurethane coating compositions | ICI RESINS BV (NL) | 1989-09-13 | — | — | EP | disclosed |