Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRC | P08575 | 2/20 | 0.48 |
| ▸ | CTSL | P07711 | 1/20 | 0.48 |
| ▸ | CTSS | P25774 | 1/20 | 0.48 |
| ▸ | PTPN13 | Q12923 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12854133 | 1.00 | PTPRC (0.48) | PTPRCCTSLCTSSPTPN13CYP3A4 | |
| SCHEMBL27924774 | 0.94 | CYP3A4 (0.46) | PTPRCCTSLCTSSPTPN13CYP3A4 | |
| SCHEMBL14124513 | 0.91 | HSD11B1 (0.44) | PTPRCCTSLCTSSPTPN13CYP3A4 | |
| SCHEMBL12854126 | 0.85 | ALDH1A1 (0.48) | CYP3A4CYP1A2CYP2C19CYP2D6TDP1 | |
| SCHEMBL11910213 | 0.82 | PTPRC (0.67) | PTPRCCTSLCTSSPTPN13CYP3A4 | |
| SCHEMBL22929973 | 0.82 | PTPRC (0.67) | PTPRCCTSLCTSSPTPN13CYP3A4 | |
| SCHEMBL14935529 | 0.82 | PTPRC (0.67) | PTPRCCTSLCTSSPTPN13CYP3A4 | |
| SCHEMBL28420415 | 0.82 | PTPRC (0.67) | PTPRCCTSLCTSSPTPN13CYP3A4 | |
| SCHEMBL28273066 | 0.81 | PTPRC (0.44) | PTPRCCTSLCTSSPTPN13CYP3A4 | |
| SCHEMBL8022901 | 0.79 | HSD11B1 (0.54) | CYP3A4CYP1A2CYP2C19CYP2D6TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2375904-A1 | BIARYL CARBOXAMIDES | Merck Sharp & Dohme Corp. (US) | 2011-10-19 | — | — | EP | claimed |