Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | GGT1 | P19440 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL8054827 | 1.00 | CYP3A4 (0.45) | CYP3A4SIGMAR1ALDH1A1LMNACA12 | |
| SCHEMBL7466897 | 1.00 | CYP3A4 (0.45) | CYP3A4SIGMAR1ALDH1A1LMNACA12 | |
| SCHEMBL8211584 | 0.90 | GGT1 (0.56) | SIGMAR1LMNAKDM4EGAACYP2D6 | |
| SCHEMBL8211581 | 0.90 | GGT1 (0.56) | SIGMAR1LMNAKDM4EGAACYP2D6 | |
| Hydrochloric Acid SCHEMBL8209005 | 0.89 | GGT1 (0.55) | SIGMAR1KDM4EGAACYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL8209008 | 0.89 | GGT1 (0.55) | SIGMAR1KDM4EGAACYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL11100782 | 0.89 | GGT1 (0.55) | SIGMAR1KDM4EGAACYP2D6CYP2C9 | |
| SCHEMBL30882505 | 0.87 | OPRK1 (0.49) | CYP3A4SIGMAR1ALDH1A1LMNACA12 | |
| SCHEMBL30882671 | 0.87 | OPRK1 (0.49) | CYP3A4SIGMAR1ALDH1A1LMNACA12 | |
| SCHEMBL7469306 | 0.86 | GGT1 (0.54) | CYP3A4SIGMAR1ALDH1A1LMNACA12 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0764648-B1 | Cephem derivatives and process for the preparation thereof | EISAI CO LTD (JP) | 2002-01-16 | — | — | EP | disclosed |
| EP-0333154-B1 | Process for the preparation of cephem derivatives | EISAI CO LTD (JP) | 1997-07-16 | — | — | EP | disclosed |
| EP-0764648-A1 | Cephem derivatives and process for the preparation thereof | Eisai Co., Ltd. (JP) | 1997-03-26 | — | — | EP | disclosed |
| EP-0612751-A2 | Compounds for the preparation of cephem derivatives | Eisai Co., Ltd. (JP) | 1994-08-31 | — | — | EP | disclosed |
| US-5128465-A | Containing thiadiazole ring and fluorine substitution | EISAI CO., LTD. (JP) | 1992-07-07 | — | — | US | disclosed |
| EP-0333154-A2 | Process for the preparation of cephem derivatives and intermediates therefor | Eisai Co., Ltd. (JP) | 1989-09-20 | — | — | EP | disclosed |