Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT2B | Q92831 | 3/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | SIRT5 | Q9NXA8 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.46 |
| ▸ | BCL6 | P41182 | 1/20 | 0.46 |
| ▸ | BCOR | Q6W2J9 | 1/20 | 0.46 |
| ▸ | GRK6 | P43250 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29126150 | 1.00 | KAT2B (0.63) | KAT2BMAPTALDH1A1HPGDSIRT5 | |
| SCHEMBL6969883 | 0.84 | MAPT (0.59) | KAT2BMAPTALDH1A1BCL6BCOR | |
| SCHEMBL9301331 | 0.83 | KAT2B (0.51) | KAT2BMAPTALDH1A1SIRT5HCAR3 | |
| SCHEMBL31737331 | 0.83 | MAPT (0.60) | MAPTALDH1A1HPGDSIRT5TSHR | |
| SCHEMBL3636228 | 0.82 | KAT2B (0.69) | KAT2BMAPTALDH1A1CYP3A4TSHR | |
| SCHEMBL9301798 | 0.80 | KAT2B (0.60) | KAT2BMAPTALDH1A1GRK6 | |
| SCHEMBL5026709 | 0.79 | KAT2B (0.60) | KAT2BMAPTALDH1A1HPGDNPC1 | |
| SCHEMBL9362338 | 0.79 | MAPT (0.47) | KAT2BMAPTALDH1A1HPGDSIRT5 | |
| SCHEMBL981242 | 0.79 | KAT2B (0.64) | KAT2BMAPTALDH1A1CYP3A4TSHR | |
| SCHEMBL24185371 | 0.78 | KAT2B (0.64) | KAT2BMAPTALDH1A1CYP3A4TSHR |
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-117247358-A | Benzodiazepine compound with HDAC6 inhibition activity and preparation method and application thereof | 上海医药工业研究院有限公司 | 2023-12-19 | — | — | CN | disclosed |