Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR5 | Q9H228 | 14/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 13/20 | 0.46 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3322574 | 0.87 | S1PR5 (0.54) | S1PR5S1PR1 | |
| SCHEMBL27712615 | 0.86 | TNIK (0.47) | S1PR5S1PR1HRH3HDAC1HDAC6 | |
| SCHEMBL4194903 | 0.86 | TNIK (0.47) | S1PR5S1PR1HRH3HDAC1HDAC6 | |
| SCHEMBL2767693 | 0.86 | GBA1 (0.47) | S1PR5S1PR1S1PR3S1PR4HRH4 | |
| SCHEMBL2766832 | 0.84 | KDM4E (0.43) | S1PR5S1PR1S1PR3S1PR4HRH4 | |
| SCHEMBL17079040 | 0.81 | KDM4E (0.51) | — | |
| SCHEMBL2768306 | 0.81 | KDM4E (0.53) | — | |
| SCHEMBL17078936 | 0.81 | HDAC6 (0.61) | HDAC1HDAC6 | |
| SCHEMBL28653669 | 0.81 | MGLL (0.51) | — | |
| SCHEMBL28653667 | 0.81 | MGLL (0.51) | — |
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-113521299-A | Pyrazolopyrimidine derivative or conjugate thereof, preparation method and application thereof | 江苏恒瑞医药股份有限公司 | 2021-10-22 | — | — | CN | disclosed |