Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10288078 | 0.79 | ALDH1A1 (0.51) | ALDH1A1POLBCNR2MAPK1RECQL | |
| SCHEMBL10288334 | 0.72 | ALDH1A1 (0.50) | ALDH1A1POLBMAPK1HPGDHSD17B10 | |
| SCHEMBL10298244 | 0.70 | ALDH1A1 (0.44) | ALDH1A1POLBCNR2MAPK1RECQL | |
| SCHEMBL3120329 | 0.67 | ALDH1A1 (0.47) | ALDH1A1POLBCNR2HPGDHSD17B10 | |
| SCHEMBL10288080 | 0.67 | HSD17B10 (0.53) | ALDH1A1MAPK1HPGDHSD17B10ALOX15 | |
| SCHEMBL623010 | 0.66 | PIK3CA (0.50) | ALDH1A1POLBMAPK1NPSR1HPGD | |
| SCHEMBL10298239 | 0.65 | ALDH1A1 (0.47) | ALDH1A1POLBMAPK1HPGDHSD17B10 | |
| SCHEMBL3403839 | 0.65 | PIK3CA (0.51) | ALDH1A1POLBMAPK1HPGDHSD17B10 | |
| SCHEMBL3399003 | 0.65 | PIK3CA (0.49) | ALDH1A1POLBHPGDHSD17B10ALOX15 | |
| SCHEMBL3401685 | 0.65 | PIK3CA (0.49) | ALDH1A1POLBHPGDKDM4EKMT2A |
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-2012021696-A1 | HETEROARYLS AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2012-02-16 | — | — | WO | disclosed |