Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 19/20 | 0.58 |
| ▸ | S1PR3 | Q99500 | 8/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.53 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.53 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.51 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28637385 | 0.89 | S1PR1 (0.56) | S1PR1S1PR3 | |
| Hydrochloric Acid SCHEMBL28647662 | 0.87 | S1PR1 (0.63) | S1PR1S1PR3KCNH2S1PR5MAP4K4 | |
| Hydrochloric Acid SCHEMBL28645680 | 0.85 | MAP4K4 (0.63) | S1PR1S1PR3KCNH2S1PR5MAP4K4 | |
| SCHEMBL28636393 | 0.84 | S1PR1 (0.60) | S1PR1S1PR3KCNH2S1PR5MAP4K4 | |
| SCHEMBL1967407 | 0.80 | MAP4K4 (0.78) | S1PR1S1PR3S1PR5MAP4K4MINK1 | |
| Hydrochloric Acid SCHEMBL28643611 | 0.79 | S1PR1 (0.60) | S1PR1S1PR3S1PR5MAP4K4MINK1 | |
| Hydrochloric Acid SCHEMBL28639078 | 0.78 | S1PR1 (0.60) | S1PR1S1PR3S1PR5 | |
| Hydrochloric Acid SCHEMBL28651669 | 0.78 | MAP4K4 (0.61) | S1PR1S1PR3S1PR5MAP4K4MINK1 | |
| SCHEMBL28643618 | 0.77 | S1PR1 (0.59) | S1PR1S1PR3KCNH2S1PR5 | |
| SCHEMBL2927101 | 0.76 | S1PR1 (0.57) | S1PR1S1PR3KCNH2S1PR5 |
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-107827837-B | Sphingosine-1-phosphate receptor modulator compounds, and preparation method and application thereof | 苏州朗科生物技术股份有限公司 | 2021-09-24 | — | — | CN | disclosed |