Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.35 |
| ▸ | VHL | P40337 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.34 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.34 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | POLQ | O75417 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27837168 | 0.89 | MAP3K14 (0.38) | MCL1ALPLCA9TP53POLB | |
| SCHEMBL16613002 | 0.82 | KMO (0.42) | KDM4EALDH1A1LMNAMAPTHCRTR2 | |
| SCHEMBL10432300 | 0.80 | KMO (0.40) | KDM4EKMT2AMEN1ALDH1A1POLQ | |
| SCHEMBL10432895 | 0.80 | KMO (0.43) | KDM4EKMT2AMEN1 | |
| SCHEMBL10432526 | 0.79 | KDM4E (0.57) | KDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL1970247 | 0.78 | KDM4E (0.61) | MCL1ALPLCA9POLBKDM4E | |
| SCHEMBL14632042 | 0.77 | ALPL (0.40) | MCL1ALPLCA9TP53MAP3K14 | |
| SCHEMBL18060545 | 0.76 | CYP1A2 (0.50) | TP53KDM4EKMT2AMEN1CSNK2A1 | |
| SCHEMBL15189691 | 0.76 | RORB (0.44) | POLBKDM4EKMT2AMEN1ALDH1A1 | |
| SCHEMBL16613055 | 0.75 | MKNK1 (0.46) | POLQLMNA |
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-2675801-B1 | NOVEL PYRAZOLE AND IMIDAZOLE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2015-04-08 | — | — | EP | claimed |