Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.40 |
| ▸ | BCL2 | P10415 | 5/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 2/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22143911 | 1.00 | KLK5 (0.43) | KLK5SCN9ABCL2CYP3A4SCN10A | |
| SCHEMBL2890943 | 0.87 | CTSS (0.47) | KLK5SCN9ABCL2CTSSCTSK | |
| SCHEMBL864694 | 0.83 | KLK5 (0.53) | KLK5BCL2CTSSCTSKPTPN1 | |
| SCHEMBL1819934 | 0.83 | KLK5 (0.53) | KLK5BCL2CTSSCTSKPTPN1 | |
| SCHEMBL7442384 | 0.83 | KLK5 (0.53) | KLK5BCL2CTSSCTSKPTPN1 | |
| SCHEMBL31277258 | 0.82 | MAPT (0.49) | KLK5SCN9ACYP3A4SCN10ACTSS | |
| SCHEMBL22425268 | 0.81 | KLK5 (0.47) | KLK5SCN9ACYP3A4SCN10ACTSS | |
| SCHEMBL28599848 | 0.81 | KLK5 (0.47) | KLK5SCN9ACYP3A4SCN10ACTSS | |
| SCHEMBL27564123 | 0.81 | TACR1 (0.50) | KLK5SCN9ACYP3A4SCN10ACTSS | |
| SCHEMBL31689558 | 0.80 | KLK5 (0.48) | KLK5SCN9ACYP3A4SCN10ACTSS |
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-113164448-A | Amino acid anilines as small molecule modulators of IL-17 | 利奥制药有限公司 | 2021-07-23 | — | — | CN | disclosed |
| WO-2020127685-A1 | AMINO-ACID ANILIDES AS SMALL MOLECULE MODULATORS OF IL-17 | LEO PHARMA A/S (DK) | 2020-06-25 | — | — | WO | disclosed |