Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | PRF1 | P14222 | 4/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TYMS | P04818 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29581702 | 1.00 | MAPT (0.49) | MAPTLMNAGAAPRF1MAOA | |
| SCHEMBL29915220 | 0.78 | MAOA (0.38) | MAPTLMNAGAAMAOAMAOB | |
| SCHEMBL3942620 | 0.74 | ALDH1A1 (0.43) | MAPTLMNAGAAMAOAMAOB | |
| SCHEMBL29581269 | 0.73 | ALDH1A1 (0.41) | MAPTLMNARAB9ASMN1; SMN2KDM4E | |
| SCHEMBL28895145 | 0.73 | ALDH1A1 (0.41) | MAPTLMNARAB9ASMN1; SMN2KDM4E | |
| SCHEMBL31474174 | 0.69 | AAK1 (0.43) | MAPTLMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30640297 | 0.69 | MAOA (0.36) | MAPTLMNAGAAMAOAMAOB | |
| SCHEMBL1610662 | 0.69 | MAOA (0.36) | MAPTLMNAGAAMAOAMAOB | |
| SCHEMBL12696414 | 0.69 | CASP1 (0.46) | PARP1HSD17B10 | |
| SCHEMBL13850777 | 0.67 | MAOA (0.46) | GAAMAOAMAOBNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-114315805-A | Aromatic ring-fused cyclic lactone thiohydantoin compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2022-04-12 | — | — | CN | disclosed |