Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 4/20 | 0.42 |
| ▸ | CNR1 | P21554 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TOP2A | P11388 | 4/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | 0.85 | RORC (0.40) | CNR2CNR1MEN1KMT2ATSHR | |
| SCHEMBL2072626 | 0.83 | CYP2C9 (0.47) | MEN1KMT2ATSHRPMP22CYP1A2 | |
| SCHEMBL7306471 | 0.79 | KDM4C (0.50) | CNR2CNR1MEN1KMT2ATSHR | |
| Hydrochloric Acid SCHEMBL7304385 | 0.78 | HTR3A (0.55) | MEN1KMT2ATSHRCYP3A4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7304390 | 0.78 | HTR3A (0.55) | MEN1KMT2ATSHRCYP3A4ALDH1A1 | |
| SCHEMBL7304429 | 0.76 | HTT (0.42) | MEN1KMT2ANPSR1RORCPKM | |
| SCHEMBL7307538 | 0.74 | KDM4E (0.46) | KMT2ATSHRPMP22RORCALDH1A1 | |
| SCHEMBL3017718 | 0.74 | TSHR (0.53) | CNR2CNR1MEN1KMT2ATSHR | |
| SCHEMBL2069985 | 0.73 | CYP1A2 (0.49) | MEN1KMT2ACYP1A2PKMALDH1A1 | |
| SCHEMBL8637494 | 0.73 | RORC (0.49) | CYP1A2HIF1ANPSR1RORCALDH1A1 |
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-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 |