Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NME4 | O00746 | 2/20 | 0.32 |
| ▸ | GCDH | Q92947 | 2/20 | 0.32 |
| ▸ | SIRT5 | Q9NXA8 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20748646 | 0.83 | ALDH1A1 (0.36) | MEN1KMT2AALDH1A1HTTL3MBTL1 | |
| SCHEMBL20748481 | 0.81 | NOTUM (0.41) | BRD4TDP1SMYD3 | |
| SCHEMBL20748517 | 0.75 | — | — | |
| SCHEMBL29953684 | 0.73 | SMYD3 (0.51) | EGLN1MEN1KMT2AALDH1A1BRD4 | |
| SCHEMBL20748611 | 0.72 | MEN1 (0.39) | MEN1KMT2AALDH1A1FABP4MAPK1 | |
| SCHEMBL20748604 | 0.71 | BRD4 (0.41) | KMT2AALDH1A1BRD4HTTL3MBTL1 | |
| SCHEMBL20748511 | 0.69 | NOTUM (0.39) | TDP1SMYD3 | |
| SCHEMBL29953018 | 0.66 | MEN1 (0.52) | MEN1KMT2AALDH1A1FABP4MAPK1 | |
| SCHEMBL29958499 | 0.64 | MAPK1 (0.54) | MEN1KMT2AALDH1A1ITGB3ITGA2B | |
| SCHEMBL394245 | 0.64 | FABP4 (0.59) | ALDH1A1CA1CA2ITGB3ITGA2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-2473501-B1 | COMPOUNDS AS TYROSINE KINASE MODULATORS | ALLERGAN INC (US) | 2019-02-20 | — | — | EP | disclosed |