Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | RECQL | P46063 | 1/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 SCHEMBL8761355 | 0.94 | CYP3A4 (0.60) | CYP3A4CYP1A2RECQLMAPK1MMP1 | |
| Maleic Acid SCHEMBL8761341 | 0.94 | CYP3A4 (0.60) | CYP3A4CYP1A2RECQLMAPK1MMP1 | |
| Remacemide SCHEMBL151148 | 0.80 | CYP1A2 (1.00) | CYP3A4CYP1A2RECQLMAPK1SMN1; SMN2 | |
| Remacemide SCHEMBL20769836 | 0.80 | CYP1A2 (1.00) | CYP3A4CYP1A2RECQLMAPK1SMN1; SMN2 | |
| SCHEMBL8761086 | 0.80 | CYP3A4 (0.64) | CYP3A4CYP1A2RECQLMAPK1MMP1 | |
| Remacemide SCHEMBL635940 | 0.79 | MAPK1 (1.00) | CYP3A4CYP1A2RECQLMAPK1SMN1; SMN2 | |
| SCHEMBL8761350 | 0.76 | CYP3A4 (0.39) | CYP3A4CYP1A2RECQLMAPK1MMP1 | |
| SCHEMBL5300822 | 0.76 | CYP3A4 (0.84) | CYP3A4CYP1A2RECQLMAPK1SMN1; SMN2 | |
| SCHEMBL5312089 | 0.76 | CYP3A4 (0.70) | CYP3A4CYP1A2RECQLMAPK1SMN1; SMN2 | |
| SCHEMBL9054250 | 0.76 | CYP3A4 (0.84) | CYP3A4CYP1A2RECQLMAPK1SMN1; SMN2 |
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-0557305-B1 | (2-THIENYL) ALKYLAMINE DERIVATIVES HAVING NEUROPROTECTIVE PROPERTIES | ASTRA AB (SE) | 1997-06-11 | — | — | EP | claimed |