Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 8/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.48 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4039305 | 0.85 | MAPT (0.57) | MAPTNPSR1GAAALDH1A1TDP1 | |
| SCHEMBL4035224 | 0.85 | MAPT (0.57) | MAPTNPSR1GAAALDH1A1TDP1 | |
| SCHEMBL4037834 | 0.80 | KMT2A (0.68) | MAPTNPSR1GAAALDH1A1MEN1 | |
| SCHEMBL30080659 | 0.80 | KMT2A (0.68) | MAPTNPSR1GAAALDH1A1MEN1 | |
| SCHEMBL13748796 | 0.80 | LCK (0.65) | MAPTNPSR1GAAALDH1A1TDP1 | |
| SCHEMBL13748313 | 0.79 | TEK (0.44) | MAPTNPSR1GAAALDH1A1TDP1 | |
| SCHEMBL17936093 | 0.74 | MAPT (0.74) | MAPTMEN1KMT2AHTTRAB9A | |
| SCHEMBL17818404 | 0.74 | MAPT (0.70) | MAPTMEN1KMT2AHTTRAB9A | |
| SCHEMBL933875 | 0.72 | PTPN1 (0.61) | ALDH1A1IDO1 | |
| SCHEMBL29890941 | 0.72 | PTPN1 (0.61) | ALDH1A1IDO1 |
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-2009100536-A1 | INHIBITORS OF KINASE ACTIVITY WITH 1,2-DI-CYCLYL SUBSTITUTED ALKYNE STRUCTURES | METHYLGENE INC. (CA) | 2009-08-20 | — | — | WO | disclosed |