Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.50 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.50 |
| ▸ | GBA1 | P04062 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | BACE1 | P56817 | 2/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1927395 | 0.82 | KDM4E (0.51) | S1PR1ALDH1A1MEN1KMT2AACHE | |
| SCHEMBL60509 | 0.81 | FUCA1 (0.55) | S1PR1S1PR5ALDH1A1ACHE | |
| SCHEMBL12187772 | 0.81 | FUCA1 (0.55) | S1PR1S1PR5ALDH1A1ACHE | |
| SCHEMBL8039299 | 0.81 | S1PR1 (0.53) | S1PR1S1PR5GBA1LMNAALDH1A1 | |
| SCHEMBL24663838 | 0.81 | PIK3CD (0.51) | S1PR1S1PR5KMT2AHRH4HRH3 | |
| SCHEMBL15317747 | 0.81 | S1PR1 (0.48) | S1PR1S1PR5ALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11836687 | 0.80 | FUCA1 (0.53) | S1PR1S1PR5ALDH1A1ACHE | |
| SCHEMBL12383 | 0.80 | ALDH1A1 (0.55) | S1PR1S1PR5GBA1LMNAALDH1A1 | |
| SCHEMBL2920097 | 0.76 | GBA1 (0.61) | S1PR1S1PR5GBA1LMNAALDH1A1 | |
| SCHEMBL22254430 | 0.76 | S1PR1 (0.54) | S1PR1S1PR5GBA1LMNAALDH1A1 |
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-2655357-B1 | INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS | MERCK SERONO SA (CH) | 2016-06-22 | — | — | EP | disclosed |