Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 3/20 | 0.68 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.68 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.68 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.60 |
| ▸ | SPHK2 | Q9NRA0 | 5/20 | 0.47 |
| ▸ | SPHK1 | Q9NYA1 | 5/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | GBA2 | Q9HCG7 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD5 | P21918 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10752656 | 0.94 | S1PR1 (0.70) | S1PR1S1PR3S1PR5S1PR4SPHK2 | |
| SCHEMBL27853068 | 0.94 | S1PR1 (0.70) | S1PR1S1PR3S1PR5S1PR4SPHK2 | |
| SCHEMBL28320436 | 0.94 | S1PR1 (0.70) | S1PR1S1PR3S1PR5S1PR4SPHK2 | |
| SCHEMBL28331601 | 0.94 | S1PR1 (0.70) | S1PR1S1PR3S1PR5S1PR4SPHK2 | |
| SCHEMBL10757053 | 0.94 | S1PR1 (0.70) | S1PR1S1PR3S1PR5S1PR4SPHK2 | |
| SCHEMBL28275983 | 0.94 | S1PR1 (0.70) | S1PR1S1PR3S1PR5S1PR4SPHK2 | |
| SCHEMBL3261999 | 0.94 | S1PR1 (0.68) | S1PR1S1PR3S1PR5S1PR4SPHK2 | |
| SCHEMBL10744955 | 0.94 | S1PR1 (0.70) | S1PR1S1PR3S1PR5S1PR4SPHK2 | |
| SCHEMBL7023481 | 0.94 | S1PR1 (0.60) | S1PR1S1PR3S1PR5S1PR4SPHK2 | |
| Bromide SCHEMBL28813801 | 0.93 | S1PR1 (0.68) | S1PR1S1PR3S1PR5S1PR4SPHK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4108659-A1 | NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS | Jacobio Pharmaceuticals Co., Ltd. (CN) | 2022-12-28 | — | — | EP | disclosed |