Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 12/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.39 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 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 | |
|---|---|---|---|---|
| SCHEMBL30740802 | 1.00 | S1PR1 (0.41) | S1PR1SIGMAR1MAP2K4MRGPRX4NPC1 | |
| SCHEMBL30740819 | 0.86 | SIGMAR1 (0.36) | SIGMAR1MRGPRX4NPC1JAK2ALDH1A1 | |
| SCHEMBL30740685 | 0.76 | GBA1 (0.43) | HTT | |
| SCHEMBL29103622 | 0.76 | MRGPRX4 (0.48) | MRGPRX4NPC1ALDH1A1RAB9A | |
| SCHEMBL11273774 | 0.74 | CHKA (0.54) | S1PR1SIGMAR1MRGPRX4 | |
| SCHEMBL27332 | 0.70 | ALDH1A1 (0.54) | S1PR1ALDH1A1 | |
| SCHEMBL12937987 | 0.69 | ENPP2 (0.47) | S1PR1 | |
| SCHEMBL10735 | 0.68 | — | — | |
| SCHEMBL22941841 | 0.68 | S1PR1 (0.46) | S1PR1MAP2K4 | |
| SCHEMBL15463290 | 0.67 | TRPA1 (0.42) | SIGMAR1ALDH1A1 |
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-117043154-A | GPCR receptor agonists, pharmaceutical compositions comprising same, and methods of use thereof | 卡莫特医疗有限公司 | 2023-11-10 | — | — | CN | disclosed |