Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18082769 | 0.88 | ALDH1A1 (0.46) | ALDH1A1MAPTPOLBL3MBTL1CYP1A2 | |
| SCHEMBL949323 | 0.81 | ALDH1A1 (0.61) | ALDH1A1MAPTPOLBL3MBTL1CYP1A2 | |
| SCHEMBL12912 | 0.79 | ALDH1A1 (0.47) | ALDH1A1MAPTPOLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL12449671 | 0.79 | ALDH1A1 (0.47) | ALDH1A1MAPTPOLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL3439885 | 0.78 | ATM (0.62) | ALDH1A1MAPTPOLBL3MBTL1CYP1A2 | |
| SCHEMBL2606054 | 0.74 | NPC1 (0.62) | ALDH1A1MAPTPOLBL3MBTL1CYP1A2 | |
| SCHEMBL2603233 | 0.73 | ELANE (0.46) | ALDH1A1MAPTPOLBL3MBTL1GAA | |
| SCHEMBL20262772 | 0.73 | ALDH1A1 (0.52) | ALDH1A1MAPTPOLBL3MBTL1CYP1A2 | |
| SCHEMBL13419165 | 0.72 | HRH3 (0.49) | ALDH1A1MAPTPOLBL3MBTL1GAA | |
| SCHEMBL13203 | 0.72 | HRH3 (0.46) | ALDH1A1MAPTPOLBL3MBTL1CYP1A2 |
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-2499146-B1 | TRICYCLIC PYRAZOL AMINE DERIVATIVES | MERCK SERONO SA (CH) | 2016-09-21 | — | — | EP | disclosed |
| WO-2011058149-A1 | TRICYCLIC PYRAZOL AMINE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-05-19 | — | — | WO | disclosed |