Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16654253 | 0.81 | RAB9A (0.49) | ALDH1A1SMN1; SMN2KDM4ELMNAMAPT | |
| SCHEMBL12279519 | 0.79 | CSNK1D (0.45) | ALDH1A1SMN1; SMN2KDM4ELMNAMAPT | |
| SCHEMBL28882232 | 0.79 | CSNK1D (0.45) | ALDH1A1SMN1; SMN2KDM4ELMNAMAPT | |
| SCHEMBL16651065 | 0.76 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2LMNAMAPTMAPK1 | |
| SCHEMBL16651064 | 0.76 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2LMNAMAPTMAPK1 | |
| SCHEMBL2324613 | 0.75 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2KDM4ELMNAMAPT | |
| SCHEMBL31019262 | 0.75 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2KDM4ELMNAMAPT | |
| SCHEMBL2324922 | 0.75 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2KDM4ELMNAMAPT | |
| SCHEMBL26645844 | 0.73 | KDM4E (0.52) | ALDH1A1KDM4ELMNAMAPTRAB9A | |
| SCHEMBL26659825 | 0.71 | CYP2C9 (0.43) | ALDH1A1SMN1; SMN2KDM4ELMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3057586-A1 | BROMODOMAIN INHIBITORS | Celgene Quanticel Research, Inc. (US) | 2016-08-24 | — | — | EP | disclosed |
| WO-2015058160-A1 | BROMODOMAIN INHIBITORS | Quanticel Pharmaceuticals, Inc. (US) | 2015-04-23 | — | — | WO | disclosed |