Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 8/20 | 0.52 |
| ▸ | CTSL | P07711 | 5/20 | 0.51 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.50 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.50 |
| ▸ | SYK | P43405 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 5/20 | 0.49 |
| ▸ | CTSS | P25774 | 3/20 | 0.49 |
| ▸ | KLK7 | P49862 | 1/20 | 0.48 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9512398 | 1.00 | P2RX7 (0.52) | P2RX7CTSLITGB3ITGA2BSYK | |
| SCHEMBL26010144 | 0.99 | CTSL (0.52) | P2RX7CTSLITGB3ITGA2BSYK | |
| SCHEMBL16510913 | 0.92 | KLK7 (0.57) | P2RX7CTSLITGB3ITGA2BKLK7 | |
| SCHEMBL23893528 | 0.91 | CTSL (0.57) | P2RX7CTSLITGB3ITGA2BKLK7 | |
| SCHEMBL22043924 | 0.91 | CTSL (0.57) | P2RX7CTSLITGB3ITGA2BKLK7 | |
| SCHEMBL1144124 | 0.90 | P2RX7 (0.57) | P2RX7SYK | |
| SCHEMBL1144126 | 0.90 | P2RX7 (0.57) | P2RX7SYK | |
| SCHEMBL8882218 | 0.86 | KMT2A (0.47) | P2RX7CTSLITGB3ITGA2BCTSK | |
| SCHEMBL6793017 | 0.85 | SYK (0.61) | P2RX7CTSLITGB3ITGA2BSYK | |
| SCHEMBL25185922 | 0.85 | CASP1 (0.59) | CTSLCTSKCTSSCASP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0254545-B1 | DIAMINE COMPOUNDS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-10-06 | — | — | EP | disclosed |
| EP-0254545-A2 | Diamine compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-01-27 | — | — | EP | disclosed |