Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | TYR | P14679 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6171017 | 1.00 | ALDH1A1 (0.47) | ALDH1A1MAPTKDM4EHPGDALOX15 | |
| SCHEMBL6171404 | 0.88 | ALDH1A1 (0.47) | ALDH1A1MAPTKDM4EHPGDALOX15 | |
| SCHEMBL6171397 | 0.88 | ALDH1A1 (0.47) | ALDH1A1MAPTKDM4EHPGDALOX15 | |
| SCHEMBL14465342 | 0.86 | ALDH1A1 (0.55) | ALDH1A1MAPTKDM4EHPGDALOX15 | |
| SCHEMBL8125136 | 0.83 | EGFR (0.50) | ALDH1A1KDM4EGAACA1CA2 | |
| SCHEMBL8125134 | 0.83 | EGFR (0.50) | ALDH1A1KDM4EGAACA1CA2 | |
| SCHEMBL14533804 | 0.82 | ALDH1A1 (0.47) | ALDH1A1MAPTKDM4EHPGDALOX15 | |
| SCHEMBL5392742 | 0.81 | ALDH1A1 (0.51) | ALDH1A1MAPTKDM4EHPGDALOX15 | |
| SCHEMBL5392736 | 0.81 | ALDH1A1 (0.51) | ALDH1A1MAPTKDM4EHPGDALOX15 | |
| SCHEMBL6169905 | 0.80 | ALDH1A1 (0.50) | ALDH1A1MAPTKDM4EHPGDALOX15 |
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-1045833-B1 | 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS | PFIZER (US) | 2005-11-02 | — | — | EP | disclosed |
| US-6608070-B1 | Useful for treatment of medical condition in which prostaglandins are implicated as pathogens | NAKAO KAZUNARI (JP) | 2003-08-19 | — | — | US | disclosed |