Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 18/20 | 0.55 |
| ▸ | S1PR3 | Q99500 | 7/20 | 0.53 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.52 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.50 |
| ▸ | MINK1 | Q8N4C8 | 2/20 | 0.50 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28651676 | 0.92 | S1PR1 (0.51) | S1PR1S1PR3S1PR5MAP4K4MINK1 | |
| SCHEMBL28636402 | 0.89 | S1PR1 (0.58) | S1PR1S1PR3S1PR5 | |
| SCHEMBL28925145 | 0.89 | S1PR1 (0.58) | S1PR1S1PR3S1PR5MAP4K4MINK1 | |
| SCHEMBL28925135 | 0.88 | S1PR1 (0.46) | S1PR1S1PR3S1PR5MAP4K4MINK1 | |
| SCHEMBL28638868 | 0.85 | S1PR1 (0.39) | S1PR1S1PR3S1PR5MAP4K4MINK1 | |
| SCHEMBL3741047 | 0.79 | S1PR1 (0.73) | S1PR1S1PR3S1PR5MAP4K4MINK1 | |
| SCHEMBL28636433 | 0.79 | RAB9A (0.46) | S1PR1S1PR5 | |
| SCHEMBL28656533 | 0.78 | S1PR1 (0.57) | S1PR1S1PR3S1PR5MAP4K4MINK1 | |
| SCHEMBL28638150 | 0.78 | NPC1 (0.46) | S1PR1S1PR3S1PR5 | |
| SCHEMBL28638343 | 0.78 | S1PR1 (0.58) | S1PR1S1PR3S1PR5 |
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-109956912-B | Carboxylic acid compound containing diphenyl oxadiazole, preparation method and medical application thereof | 中国医学科学院药物研究所 | 2021-10-22 | — | — | CN | disclosed |