Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL30648677 | 0.79 | CYP2C19 (0.47) | MAPTCYP2C19POLBOPRK1ALDH1A1 | |
| SCHEMBL24778551 | 0.79 | CYP2C19 (0.47) | MAPTCYP2C19POLBOPRK1ALDH1A1 | |
| SCHEMBL289465 | 0.79 | CYP4F2 (0.40) | MAPTPOLBOPRK1ALDH1A1CYP1A2 | |
| SCHEMBL30745103 | 0.79 | CYP4F2 (0.40) | MAPTPOLBOPRK1ALDH1A1CYP1A2 | |
| SCHEMBL29572125 | 0.78 | MAPT (0.40) | MAPTPOLBOPRK1ALDH1A1MEN1 | |
| SCHEMBL29187351 | 0.78 | MEN1 (0.46) | MAPTCYP2C19POLBOPRK1ALDH1A1 | |
| SCHEMBL17544367 | 0.78 | ALDH1A1 (0.40) | MAPTPOLBALDH1A1GLACYP1A2 | |
| SCHEMBL30402328 | 0.78 | ALDH1A1 (0.40) | MAPTPOLBALDH1A1GLACYP1A2 | |
| SCHEMBL30849372 | 0.78 | KDM4E (0.40) | MAPTPOLBOPRK1ALDH1A1CYP1A2 | |
| SCHEMBL18668409 | 0.78 | MAPT (0.40) | MAPTPOLBOPRK1ALDH1A1MEN1 |
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 |