Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | PYGL | P06737 | 6/20 | 0.38 |
| ▸ | PYGM | P11217 | 4/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27800262 | 0.89 | PYGL (0.41) | EPHX2MAPK1PYGLPYGMANPEP | |
| SCHEMBL27779054 | 0.89 | PYGL (0.41) | EPHX2MAPK1PYGLPYGMANPEP | |
| SCHEMBL29715311 | 0.83 | CREBBP (0.51) | BRD4CREBBPPYGLPYGMGAA | |
| SCHEMBL653949 | 0.83 | CREBBP (0.51) | BRD4CREBBPPYGLPYGMGAA | |
| SCHEMBL4805157 | 0.83 | CREBBP (0.51) | BRD4CREBBPPYGLPYGMGAA | |
| SCHEMBL4802691 | 0.83 | CREBBP (0.51) | BRD4CREBBPPYGLPYGMGAA | |
| Hydrochloric Acid SCHEMBL4069079 | 0.81 | ANPEP (0.50) | BRD4CREBBPPYGLPYGMMAPT | |
| Hydrochloric Acid SCHEMBL4068419 | 0.81 | ANPEP (0.50) | BRD4CREBBPPYGLPYGMMAPT | |
| Hydrochloric Acid SCHEMBL4065054 | 0.81 | ANPEP (0.50) | BRD4CREBBPPYGLPYGMMAPT | |
| SCHEMBL29035761 | 0.79 | PYGL (0.39) | EPHX2MAPK1PYGLPYGMMTNR1A |
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-0166354-B1 | BENZOFUSED LACTAM COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MERCK & CO. INC. (US) | 1992-08-05 | — | — | EP | disclosed |
| US-4873235-A | COUPLING KETO ESTER WITH LACTAM; ANGIOTENSIN CONVERTING ENZYME INHIBITORS | MERCK & CO., INC. (US) | 1989-10-10 | — | — | US | disclosed |
| US-4684645-A | GASTROINTESTINAL AND NERVOUS SYSTEM DISORDERS | MERCK & CO., INC. (US) | 1987-08-04 | — | — | US | disclosed |