Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23506238 | 1.00 | RXFP1 (0.42) | RXFP1RAB9AMAOAMAOBTAS1R3 | |
| SCHEMBL23506457 | 0.95 | RAB9A (0.41) | RXFP1RAB9AMAOAMAOBTAS1R3 | |
| SCHEMBL23506229 | 0.89 | HPGD (0.50) | RXFP1RAB9AMAOBCTSLALDH1A1 | |
| SCHEMBL21702237 | 0.89 | HPGD (0.50) | RXFP1RAB9AMAOBCTSLALDH1A1 | |
| SCHEMBL23711629 | 0.89 | HPGD (0.50) | RXFP1RAB9AMAOBCTSLALDH1A1 | |
| SCHEMBL21702240 | 0.87 | RAB9A (0.49) | RXFP1RAB9AMAOBCTSLCTSB | |
| SCHEMBL23506408 | 0.87 | RAB9A (0.49) | RXFP1RAB9AMAOBCTSLCTSB | |
| SCHEMBL23506521 | 0.86 | CTSK (0.51) | TAS1R3TAS1R1CTSLCTSB | |
| SCHEMBL23711634 | 0.86 | CTSK (0.51) | TAS1R3TAS1R1CTSLCTSB | |
| SCHEMBL21702268 | 0.86 | MEN1 (0.46) | RAB9ACTSLCTSB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020030143-A1 | KETOAMIDE COMPOUND AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION, AND USE THEREOF | 中国科学院上海药物研究所 | 2020-02-13 | — | — | WO | disclosed |