Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.53 |
| ▸ | GRM4 | Q14833 | 3/20 | 0.44 |
| ▸ | TNKS | O95271 | 2/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | CD38 | P28907 | 3/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | WNT3A | P56704 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6645728 | 0.90 | P2RX7 (0.49) | P2RX7GRM4TNKSGRM5GSK3A | |
| SCHEMBL9461756 | 0.89 | P2RX7 (0.48) | P2RX7GRM4TNKSGRM5GSK3A | |
| SCHEMBL5308759 | 0.81 | P2RX7 (0.51) | P2RX7GRM4TNKSGRM5RORC | |
| SCHEMBL7019900 | 0.77 | CD38 (0.57) | P2RX7TNKSGRM5CD38S1PR1 | |
| SCHEMBL30363652 | 0.76 | P2RX7 (0.53) | P2RX7GRM4TNKSGRM5RORC | |
| SCHEMBL25417634 | 0.75 | SMYD3 (0.55) | P2RX7TNKSCD38 | |
| SCHEMBL29998657 | 0.75 | P2RX7 (0.51) | P2RX7GRM4TNKSGRM5RORC | |
| SCHEMBL30336165 | 0.75 | SMYD3 (0.55) | P2RX7TNKSCD38 | |
| SCHEMBL30338601 | 0.75 | P2RX7 (0.51) | P2RX7GRM4TNKSGRM5GSK3A | |
| Hydrochloric Acid SCHEMBL29998785 | 0.74 | P2RX7 (0.50) | P2RX7GRM4TNKSGRM5RORC |
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-116547281-A | Isoxazolidines as RIPK1 inhibitors and uses thereof | 赛诺菲 | 2023-08-04 | — | — | CN | disclosed |