Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | RORC | P51449 | 16/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7297551 | 0.90 | RORC (0.40) | KDM4EALDH1A1LMNATSHRBLM | |
| SCHEMBL7299091 | 0.77 | TSHR (0.56) | KDM4EALDH1A1LMNATSHRBLM | |
| SCHEMBL27721950 | 0.77 | ALDH1A1 (0.44) | KDM4EALDH1A1LMNATSHRBLM | |
| Hydrochloric Acid SCHEMBL7331979 | 0.76 | HTR3A (0.61) | KDM4EALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL7331986 | 0.76 | HTR3A (0.61) | KDM4EALDH1A1TSHR | |
| SCHEMBL7340567 | 0.74 | CNR2 (0.42) | KDM4EALDH1A1LMNATSHRBLM | |
| SCHEMBL8830183 | 0.73 | RORC (0.52) | KDM4EALDH1A1LMNARORCCHRM1 | |
| SCHEMBL30212115 | 0.73 | RORC (0.52) | KDM4EALDH1A1LMNARORCCHRM1 | |
| SCHEMBL29805597 | 0.72 | TSHR (0.56) | KDM4EALDH1A1LMNATSHRBLM | |
| SCHEMBL2081436 | 0.72 | TSHR (0.56) | KDM4EALDH1A1LMNATSHRBLM |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0560604-B1 | Cinnoline-3-carboxylic acid derivatives as 5-HT3 antagonists | MITSUBISHI CHEM CORP (JP) | 1997-01-29 | — | — | EP | disclosed |
| US-5556851-A | TREATMENT OF NAUSEA OR EMESIS FROM ANTICANCER DRUGS OR X-RAY TREATMENT | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-09-17 | — | — | US | disclosed |
| US-5391549-A | Antagonistifc activity against serotonin 5HT3 receptors | MITSUBISHI KASEI CORPORATION (JP) | 1995-02-21 | — | — | US | disclosed |
| EP-0560604-A1 | Cinnoline-3-carboxylic acid derivatives as 5-HT3 antagonists | Mitsubishi Chemical Corporation (JP) | 1993-09-15 | — | — | EP | disclosed |