Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31232584 | 0.81 | TP53 (0.65) | TP53NPC1RAB9AGAACYP11B1 | |
| SCHEMBL2841879 | 0.81 | TP53 (0.65) | TP53NPC1RAB9AGAACYP11B1 | |
| SCHEMBL28997762 | 0.80 | CYP11B1 (0.55) | TP53CYP11B1CYP11B2CYP3A4CYP17A1 | |
| SCHEMBL22686772 | 0.80 | TP53 (0.51) | TP53NPC1RAB9AGAACYP11B1 | |
| SCHEMBL16110614 | 0.79 | CYP17A1 (0.50) | TP53NPC1RAB9ACYP11B1CYP11B2 | |
| SCHEMBL13545698 | 0.79 | CYP2A6 (0.53) | TP53NPC1RAB9ACYP11B1CYP11B2 | |
| SCHEMBL8126228 | 0.79 | CYP11B1 (0.49) | TP53CYP11B1CYP11B2CYP3A4CYP17A1 | |
| SCHEMBL1771368 | 0.79 | TP53 (0.50) | TP53NPC1RAB9AGAACYP11B1 | |
| SCHEMBL9655789 | 0.79 | TP53 (0.50) | TP53NPC1RAB9AGAACYP11B1 | |
| SCHEMBL19980439 | 0.77 | CYP11B1 (0.50) | TP53NPC1RAB9AGAACYP11B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5128335-A | Antibiotics | MERCK & CO., INC. (US) | 1992-07-07 | — | — | US | disclosed |
| EP-0481662-A1 | 2-Heteroarylphenyl-carbapenem antibacterial agents | MERCK & CO. INC. (US) | 1992-04-22 | — | — | EP | disclosed |