Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.56 |
| ▸ | CTSS | P25774 | 8/20 | 0.51 |
| ▸ | CTSK | P43235 | 7/20 | 0.51 |
| ▸ | CTSB | P07858 | 2/20 | 0.50 |
| ▸ | CTSL | P07711 | 1/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.48 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.48 |
| ▸ | ACE | P12821 | 1/20 | 0.48 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.46 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | AKT1 | P31749 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20415892 | 1.00 | KLK5 (0.56) | KLK5CTSSCTSKCTSBCTSL | |
| SCHEMBL8234790 | 0.89 | KLK5 (0.61) | KLK5CTSSCTSKCTSBCTSL | |
| SCHEMBL4925498 | 0.89 | KLK5 (0.61) | KLK5CTSSCTSKCTSBCTSL | |
| SCHEMBL7896684 | 0.88 | KLK5 (0.67) | KLK5CTSSCTSKCTSBCTSL | |
| SCHEMBL7544681 | 0.88 | KLK5 (0.57) | KLK5CTSSCTSKCTSBCTSL | |
| SCHEMBL18262437 | 0.88 | ACE (0.61) | CTSSCTSKCTSBCTSLITGB3 | |
| SCHEMBL18262439 | 0.88 | ACE (0.61) | CTSSCTSKCTSBCTSLITGB3 | |
| SCHEMBL7541415 | 0.87 | KLK5 (0.54) | KLK5CTSSCTSKCTSBCTSL | |
| SCHEMBL12035376 | 0.86 | KLK5 (0.58) | KLK5CTSSCTSKCTSBCTSL | |
| SCHEMBL539575 | 0.86 | CTSS (0.66) | KLK5CTSSCTSKCTSBCTSL |
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 |
|---|---|---|---|---|---|---|---|
| CN-107848962-B | Urea derivative or pharmacologically acceptable salt thereof | 杏林制药株式会社 | 2021-04-09 | — | — | CN | disclosed |
| CN-107848962-A | UREA DERIVATIVE OR PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF | 杏林制药株式会社 | 2018-03-27 | — | — | CN | disclosed |