Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | PPARG | P37231 | 5/20 | 0.47 |
| ▸ | PPARA | Q07869 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAT2A | P31153 | 1/20 | 0.38 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.38 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.38 |
| ▸ | TEAD2 | Q15562 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11543287 | 0.88 | HPGD (0.50) | BACE1PPARGPPARAHPGDHSD17B10 | |
| SCHEMBL11544309 | 0.87 | BACE1 (0.48) | BACE1PPARGPPARAHPGDHSD17B10 | |
| SCHEMBL11542615 | 0.86 | NPSR1 (0.46) | NPSR1BRD4MEN1KMT2AHTT | |
| SCHEMBL11540274 | 0.86 | NPSR1 (0.47) | HPGDHSD17B10ALDH1A1NPSR1KDM4E | |
| SCHEMBL11541055 | 0.84 | NPSR1 (0.46) | HPGDHSD17B10ALDH1A1NPSR1KDM4E | |
| SCHEMBL11540070 | 0.84 | NPSR1 (0.46) | HPGDHSD17B10ALDH1A1NPSR1KDM4E | |
| SCHEMBL11538165 | 0.83 | NPSR1 (0.51) | BACE1PPARGHPGDNPSR1KDM4E | |
| SCHEMBL11541058 | 0.81 | ALDH1A1 (0.42) | BACE1HSD17B10ALDH1A1KDM4EBRD4 | |
| SCHEMBL25042634 | 0.78 | KDM4E (0.50) | PPARGPPARAHPGDALDH1A1KDM4E | |
| SCHEMBL11544638 | 0.78 | THRB (0.45) | HPGDHSD17B10USP2ALDH1A1NPSR1 |
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-4168312-A | Quinolone derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-09-18 | — | — | US | claimed |
| US-4168312-A | Quinolone derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-09-18 | — | — | US | disclosed |