Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 14/20 | 0.53 |
| ▸ | S1PR2 | O95136 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.41 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27327664 | 0.93 | S1PR4 (0.53) | S1PR4S1PR2MAPTS1PR3S1PR1 | |
| SCHEMBL27327253 | 0.93 | S1PR4 (0.45) | S1PR4S1PR2ALDH1A1S1PR3S1PR1 | |
| SCHEMBL27327669 | 0.89 | S1PR4 (0.43) | S1PR4S1PR2MAPTALDH1A1CYP1A2 | |
| SCHEMBL27327659 | 0.89 | S1PR4 (0.51) | S1PR4S1PR2S1PR3S1PR1S1PR5 | |
| SCHEMBL27327660 | 0.88 | S1PR4 (0.41) | S1PR4S1PR2MAPTALDH1A1S1PR3 | |
| SCHEMBL27327257 | 0.87 | S1PR4 (0.48) | S1PR4S1PR2MAPTALDH1A1S1PR3 | |
| SCHEMBL27327661 | 0.86 | HSD17B2 (0.44) | S1PR4S1PR2ALDH1A1S1PR3S1PR1 | |
| SCHEMBL27327662 | 0.84 | S1PR4 (0.43) | S1PR4S1PR2MAPTALDH1A1HPGD | |
| SCHEMBL27333602 | 0.83 | ALDH1A1 (0.47) | S1PR4S1PR2MAPTALDH1A1NPSR1 | |
| SCHEMBL27327251 | 0.82 | MAPT (0.45) | S1PR4S1PR2MAPTALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024103400-A1 | POLYCYCLIC COMPOUND AS GPR75 ACTIVATOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF | 水木未来(北京)科技有限公司 | 2024-05-23 | — | — | WO | disclosed |