Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL8528965 | 0.89 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL19511038 | 0.78 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8089745 | 0.76 | ALDH1A1 (0.40) | ALDH1A1MEN1KMT2AL3MBTL1TSHR | |
| SCHEMBL1195410 | 0.73 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1TSHRSMN1; SMN2HTT | |
| SCHEMBL30311991 | 0.71 | MAPT (0.48) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL9798486 | 0.69 | HPGD (0.63) | ALDH1A1MEN1KMT2AGAATSHR | |
| SCHEMBL8201326 | 0.67 | L3MBTL1 (0.39) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL1196622 | 0.67 | PPM1B (0.38) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL3777633 | 0.67 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2AL3MBTL1TSHR | |
| SCHEMBL3785359 | 0.67 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2AL3MBTL1GAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6018054-A | INTERMEDIATE COMPOUNDS FOR PREPARING NOVEL QUINOLONE AND NAPHTHYRIDONE DERIVATIVES WHICH ARE SUBSTITUTED IN THE 7-POSITION BY A PARTIALLY HYDROGENATED ISOINDOLINYL RING, USE AS ANTIBACTERIAL AGENTS AND AS FEED ADDITIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-01-25 | — | — | US | disclosed |