Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | IKBKB | O14920 | 2/20 | 0.38 |
| ▸ | PEPD | P12955 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2948840 | 0.83 | MEN1 (0.50) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL10745860 | 0.78 | PKM (0.42) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL2593851 | 0.78 | MAPK8 (0.64) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL3247888 | 0.76 | PTPN2 (0.68) | MEN1KMT2ALMNAMAPK8MAPK10 | |
| SCHEMBL4985538 | 0.75 | CA2 (0.39) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL995011 | 0.72 | NPC1 (0.69) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL6508526 | 0.72 | PTK2 (0.40) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL29840068 | 0.71 | GAA (0.67) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL3928666 | 0.71 | GAA (0.67) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL164691 | 0.71 | — | — |
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-2003028731-A1 | CHK1 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-04-10 | — | — | WO | disclosed |