Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 6/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | ALPG | P10696 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14304682 | 0.85 | ALDH1A1 (0.50) | ALDH1A1EPHX1ATMNAAAHPGD | |
| SCHEMBL807264 | 0.85 | ALDH1A1 (0.50) | ALDH1A1EPHX1ATMNAAAHPGD | |
| SCHEMBL7375877 | 0.80 | EPHX1 (0.41) | ALDH1A1EPHX1ATMNAAAHPGD | |
| SCHEMBL2034542 | 0.79 | EPHX1 (0.55) | ALDH1A1EPHX1NAAATSHRNPSR1 | |
| SCHEMBL2846894 | 0.79 | EPHX1 (0.55) | ALDH1A1EPHX1NAAATSHRNPSR1 | |
| SCHEMBL8591965 | 0.79 | ALDH1A1 (0.38) | ALDH1A1EPHX1ATMNAAAHPGD | |
| SCHEMBL5491470 | 0.79 | ATM (0.54) | ALDH1A1EPHX1ATMNAAAHPGD | |
| SCHEMBL40274 | 0.78 | ALDH1A1 (0.61) | ALDH1A1EPHX1ATMNAAAHPGD | |
| SCHEMBL23844103 | 0.78 | EPHX1 (0.58) | ALDH1A1EPHX1NAAATSHRNPSR1 | |
| SCHEMBL21184185 | 0.78 | EPHX1 (0.58) | ALDH1A1EPHX1NAAATSHRNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999055688-A1 | SUBSTITUTED DIARYLALKYL AMIDES AS CALCIUM CHANNEL ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 1999-11-04 | — | — | WO | disclosed |