Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | LDHA | P00338 | 1/20 | 0.39 |
| ▸ | LDHB | P07195 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HMGB1 | P09429 | 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 | |
|---|---|---|---|---|
| SCHEMBL7842972 | 0.84 | KDM4E (0.40) | CYP3A4ACHEALDH1A1KDM4EHSD17B10 | |
| SCHEMBL6825251 | 0.83 | KDM4E (0.42) | ALDH1A1KDM4EHSD17B10GAAHPGD | |
| SCHEMBL29576939 | 0.83 | CYP3A4 (0.45) | CYP3A4ACHEALDH1A1KDM4EHSD17B10 | |
| SCHEMBL8730406 | 0.83 | CYP3A4 (0.45) | CYP3A4ACHEALDH1A1KDM4EHSD17B10 | |
| SCHEMBL27818807 | 0.82 | KDM4E (0.41) | CYP3A4ACHEALDH1A1KDM4EHSD17B10 | |
| SCHEMBL537616 | 0.81 | CYP3A4 (0.47) | CYP3A4ACHEALDH1A1KDM4EHSD17B10 | |
| SCHEMBL29927238 | 0.81 | CYP3A4 (0.47) | CYP3A4ACHEALDH1A1KDM4EHSD17B10 | |
| SCHEMBL3030086 | 0.81 | CYP3A4 (0.47) | CYP3A4ACHEALDH1A1KDM4EHSD17B10 | |
| SCHEMBL15259689 | 0.80 | KDM4E (0.41) | CYP3A4ACHEALDH1A1KDM4EHSD17B10 | |
| SCHEMBL4641265 | 0.78 | LDHA (0.48) | CYP3A4ACHEALDH1A1KDM4EHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5356889-A | Carbapenicillins | MERCK & CO., INC. (US) | 1994-10-18 | — | — | US | disclosed |
| EP-0472306-A1 | 2-(9-fluorenonyl)-carbapenem antibacterial agents | MERCK & CO. INC. (US) | 1992-02-26 | — | — | EP | disclosed |
| US-5034384-A | Bactericides, antibiotics for resistant bacteria | MERCK & CO., INC. (US) | 1991-07-23 | — | — | US | disclosed |