Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.53 |
| ▸ | GPR183 | P32249 | 1/20 | 0.53 |
| ▸ | FAAH | O00519 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARD | Q03181 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | IDH1 | O75874 | 3/20 | 0.45 |
| ▸ | IDH2 | P48735 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2297065 | 0.99 | SMN1; SMN2 (0.53) | SMN1; SMN2ALDH1A1HTTHRH3GPR183 | |
| SCHEMBL14108437 | 0.89 | DRD3 (0.49) | SMN1; SMN2ALDH1A1HRH3GPR183FAAH | |
| SCHEMBL2231731 | 0.88 | HRH3 (0.58) | SMN1; SMN2ALDH1A1HTTHRH3GPR183 | |
| SCHEMBL2232804 | 0.88 | HRH3 (0.58) | SMN1; SMN2ALDH1A1HTTHRH3GPR183 | |
| SCHEMBL22185391 | 0.87 | ALDH1A1 (0.68) | SMN1; SMN2ALDH1A1HTTHRH3GPR183 | |
| SCHEMBL13582370 | 0.84 | HRH3 (0.60) | SMN1; SMN2ALDH1A1HTTHRH3FAAH | |
| SCHEMBL2233177 | 0.82 | HRH3 (0.57) | SMN1; SMN2ALDH1A1HTTHRH3GPR183 | |
| SCHEMBL14110188 | 0.82 | HRH3 (0.51) | SMN1; SMN2ALDH1A1HTTHRH3FAAH | |
| SCHEMBL14108479 | 0.82 | KDM4E (0.61) | SMN1; SMN2ALDH1A1HRH3FAAHMEN1 | |
| SCHEMBL2234825 | 0.78 | HRH3 (0.51) | HRH3MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2528897-A1 | DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS | Otsuka Pharmaceutical Co., Ltd. (JP) | 2012-12-05 | — | — | EP | claimed |
| WO-2011093524-A9 | DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2011-12-01 | — | — | WO | claimed |
| WO-2011093524-A1 | DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2011-08-04 | — | — | WO | claimed |