Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CTSA | P10619 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29675785 | 1.00 | CYP26A1 (0.47) | CYP26A1KDM4EALOX12RIPK1MAPK1 | |
| SCHEMBL4597982 | 0.86 | CYP26A1 (0.50) | CYP26A1RIPK1TAS1R3TAS1R1GPR139 | |
| SCHEMBL31037006 | 0.85 | MAPK1 (0.46) | RIPK1MAPK1GPR139MEN1KMT2A | |
| SCHEMBL16901655 | 0.85 | MAPK1 (0.46) | RIPK1MAPK1GPR139MEN1KMT2A | |
| SCHEMBL29751787 | 0.85 | MAPK1 (0.46) | RIPK1MAPK1GPR139MEN1KMT2A | |
| SCHEMBL14393517 | 0.84 | CYP26A1 (0.46) | CYP26A1RIPK1MAPK1TAS1R3TAS1R1 | |
| SCHEMBL29918436 | 0.84 | CYP26A1 (0.46) | CYP26A1RIPK1MAPK1TAS1R3TAS1R1 | |
| SCHEMBL31037005 | 0.84 | ROCK1 (0.50) | CYP26A1RIPK1MAPK1GPR139ROCK2 | |
| SCHEMBL31592710 | 0.84 | RIPK1 (0.43) | RIPK1MAPK1MTNR1AMTNR1BSMN1; SMN2 | |
| SCHEMBL23961270 | 0.83 | GPR139 (0.49) | CYP26A1RIPK1MAPK1GPR139AURKA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3365334-A1 | BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS | Otsuka Pharmaceutical Co., Ltd. (JP) | 2018-08-29 | — | — | EP | disclosed |
| WO-2017068412-A1 | BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2017-04-27 | — | — | WO | disclosed |