Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA3 | P07451 | 2/20 | 0.47 |
| ▸ | CA5A | P35218 | 2/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | CA6 | P23280 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | PGK1 | P00558 | 1/20 | 0.40 |
| ▸ | PGK2 | P07205 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14439842 | 0.87 | ALDH1A1 (0.53) | ALDH1A1POLBSMN1; SMN2EPHX1MEN1 | |
| SCHEMBL14986339 | 0.77 | PPARD (0.57) | CA12CA2CA9PPARDCA1 | |
| SCHEMBL11436912 | 0.75 | PPARD (0.55) | CA12CA2CA9PPARDCA1 | |
| SCHEMBL2098393 | 0.73 | ALDH1A1 (0.62) | ALDH1A1POLBSMN1; SMN2EPHX1MEN1 | |
| SCHEMBL14299161 | 0.73 | MEN1 (0.59) | ALDH1A1POLBSMN1; SMN2EPHX1MEN1 | |
| SCHEMBL2736707 | 0.73 | EPHX1 (0.84) | ALDH1A1POLBSMN1; SMN2EPHX1MEN1 | |
| SCHEMBL2241949 | 0.73 | PPARD (0.75) | CA12CA2CA9PPARDCA1 | |
| SCHEMBL10138076 | 0.72 | ALDH1A1 (0.60) | ALDH1A1POLBSMN1; SMN2EPHX1MEN1 | |
| SCHEMBL27889238 | 0.72 | ALDH1A1 (1.00) | ALDH1A1POLBSMN1; SMN2EPHX1MEN1 | |
| SCHEMBL13824645 | 0.72 | ACHE (0.58) | CA12CA2CA9CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7649015-B2 | Cellular accumulation of phosphonate analogs of HIV protease inhibitor compounds | GILEAD SCIENCES, INC. (US) | 2010-01-19 | — | — | US | disclosed |