Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | ANO1 | Q5XXA6 | 3/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29168113 | 0.80 | CTSL (0.44) | PPARGPPARAANO1SCN9AHPGD | |
| SCHEMBL29168191 | 0.80 | PPARG (0.39) | PPARGPPARAANO1SCN9AALDH1A1 | |
| SCHEMBL29168249 | 0.79 | PPARG (0.47) | PPARGPPARAALDH1A1NPC1RAB9A | |
| SCHEMBL29168248 | 0.79 | PPARG (0.47) | PPARGPPARAALDH1A1NPC1RAB9A | |
| SCHEMBL28552846 | 0.76 | LDHA (0.43) | PPARGPPARASCN9AALDH1A1HTT | |
| SCHEMBL29168013 | 0.74 | SCN9A (0.32) | SCN9APKM | |
| SCHEMBL29168080 | 0.73 | CTSS (0.51) | PPARGPPARASCN9ACTSK | |
| SCHEMBL30133697 | 0.73 | CTSS (0.51) | PPARGPPARASCN9ACTSK | |
| SCHEMBL29168050 | 0.72 | ANO1 (0.39) | PPARGPPARAANO1SCN9AALDH1A1 | |
| SCHEMBL27741038 | 0.70 | ALDH1A1 (0.48) | ANO1ALDH1A1HPGDNPC1RAB9A |
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-117529476-A | Preparation of substituted 1, 2-diamino heterocyclic derivatives and their use as medicaments | 亚飞络思制药公司 | 2024-02-06 | — | — | CN | disclosed |