Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | AURKA | O14965 | 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 | |
|---|---|---|---|---|
| SCHEMBL15072201 | 0.86 | ALDH1A1 (0.66) | ALDH1A1KMT2AMEN1NPSR1MAPK1 | |
| SCHEMBL15072200 | 0.72 | ALDH1A1 (0.67) | ALDH1A1KMT2AMEN1NPSR1MAPK1 | |
| SCHEMBL15072197 | 0.71 | ALDH1A1 (0.66) | ALDH1A1KMT2AMEN1NPSR1MAPK1 | |
| SCHEMBL2148513 | 0.71 | BRAF (0.68) | ALDH1A1KMT2AMEN1SMN1; SMN2HPGD | |
| SCHEMBL15076914 | 0.71 | ALDH1A1 (0.89) | ALDH1A1KMT2AMEN1NPSR1MAPK1 | |
| SCHEMBL15072162 | 0.70 | ALDH1A1 (0.72) | ALDH1A1KMT2AMEN1NPSR1MAPK1 | |
| SCHEMBL15070383 | 0.68 | ALDH1A1 (0.88) | ALDH1A1KMT2AMEN1NPSR1MAPK1 | |
| SCHEMBL15070211 | 0.67 | ALDH1A1 (0.71) | ALDH1A1KMT2AMAPK1SMN1; SMN2HPGD | |
| SCHEMBL6681044 | 0.66 | ALDH1A1 (1.00) | ALDH1A1KMT2AMEN1NPSR1MAPK1 | |
| SCHEMBL12264890 | 0.65 | MAPT (1.00) | ALDH1A1KMT2AMEN1NPSR1MAPK1 |
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-2013096630-A1 | HETEROARYLS AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2013-06-27 | — | — | WO | disclosed |