Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.41 |
| ▸ | MC4R | P32245 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29227170 | 1.00 | ALDH1A1 (0.44) | ALDH1A1SLC1A5USP2HPGDPKM | |
| SCHEMBL29227251 | 0.83 | MC4R (0.51) | MC4R | |
| SCHEMBL30873545 | 0.79 | SLC1A5 (0.51) | ALDH1A1SLC1A5PKMTRPV6 | |
| SCHEMBL29227168 | 0.78 | ALDH1A1 (0.43) | ALDH1A1SLC1A5HPGDPKMKCNH2 | |
| SCHEMBL29227236 | 0.77 | TRPV6 (0.60) | ALDH1A1USP2HPGDPKMKCNH2 | |
| SCHEMBL29227161 | 0.77 | LMNA (0.52) | MC4RTSHR | |
| SCHEMBL29227249 | 0.73 | HRH3 (0.48) | ALDH1A1MC4R | |
| SCHEMBL29227194 | 0.72 | DRD2 (0.51) | MC4R | |
| SCHEMBL29227124 | 0.70 | MC4R (0.61) | MC4R | |
| SCHEMBL8283688 | 0.66 | ALDH1A1 (0.67) | ALDH1A1SLC1A5PKMABCB1RAB9A |
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-117946031-A | Substituted aromatic phenol derivatives of KNa1.1 channel inhibitors | 北京大学 | 2024-04-30 | — | — | CN | disclosed |