Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | RHOA | P61586 | 4/20 | 0.52 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.52 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | RHOC | P08134 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28589349 | 1.00 | RAB9A (0.61) | RAB9AALDH1A1NPC1KDM4ETSHR | |
| SCHEMBL17511351 | 0.93 | RAB9A (0.52) | RAB9AALDH1A1NPC1KDM4ETSHR | |
| SCHEMBL22633108 | 0.87 | RAB9A (0.53) | RAB9AALDH1A1NPC1KDM4ETSHR | |
| SCHEMBL16670841 | 0.87 | RAB9A (0.53) | RAB9AALDH1A1NPC1KDM4ETSHR | |
| SCHEMBL30507625 | 0.85 | RAB9A (0.55) | RAB9AALDH1A1NPC1KDM4ETSHR | |
| SCHEMBL18045231 | 0.85 | RAB9A (0.55) | RAB9AALDH1A1NPC1KDM4ETSHR | |
| SCHEMBL16677968 | 0.85 | RAB9A (0.55) | RAB9AALDH1A1NPC1KDM4ETSHR | |
| SCHEMBL18045232 | 0.85 | RAB9A (0.55) | RAB9AALDH1A1NPC1KDM4ETSHR | |
| SCHEMBL5554898 | 0.83 | RAB9A (0.72) | RAB9AALDH1A1POLBLMNAKMT2A | |
| SCHEMBL5554906 | 0.83 | RAB9A (0.72) | RAB9AALDH1A1POLBLMNAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-112679489-B | N-sulfonyl heterocyclic derivative and pharmaceutical use thereof | 重庆医科大学 | 2023-07-25 | — | — | CN | disclosed |
| CN-112679489-A | N-sulfonyl heterocyclic derivatives and pharmaceutical use thereof | 重庆医科大学 | 2021-04-20 | — | — | CN | disclosed |