Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 3/20 | 0.58 |
| ▸ | LTA4H | P09960 | 2/20 | 0.56 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL26247403 | 0.94 | APP (0.64) | APPLTA4HPLA2G2ATDP1TSHR | |
| SCHEMBL22109518 | 0.92 | TDP1 (0.61) | APPLTA4HPLA2G2ATDP1ALDH1A1 | |
| SCHEMBL15071342 | 0.86 | APP (0.67) | APPTDP1ALDH1A1TSHRCYP3A4 | |
| SCHEMBL4103477 | 0.86 | ALDH1A1 (0.70) | APPLTA4HPLA2G2ATDP1ALDH1A1 | |
| SCHEMBL1353069 | 0.86 | APP (0.67) | APPTDP1ALDH1A1TSHRCYP3A4 | |
| SCHEMBL7911522 | 0.86 | APP (0.67) | APPTDP1ALDH1A1TSHRCYP3A4 | |
| SCHEMBL5930961 | 0.86 | APP (0.67) | APPTDP1ALDH1A1TSHRCYP3A4 | |
| SCHEMBL7866458 | 0.82 | TAAR1 (0.62) | APPLTA4HPLA2G2ATDP1ALDH1A1 | |
| SCHEMBL4025998 | 0.80 | ALDH1A1 (0.67) | LTA4HPLA2G2ATDP1ALDH1A1TSHR | |
| SCHEMBL4017711 | 0.80 | ALDH1A1 (0.67) | LTA4HPLA2G2ATDP1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010126914-A1 | PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS | ELAN PHARMACEUTICALS, INC. (US) | 2010-11-04 | — | — | WO | disclosed |