Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | DAGLA | Q9Y4D2 | 2/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL3229757 | 0.88 | HPGD (0.50) | HPGDDAGLAABCG2ADORA2AADORA1 | |
| SCHEMBL4409289 | 0.84 | HPGD (0.55) | HPGDDAGLAABCG2NPC1RAB9A | |
| SCHEMBL4409279 | 0.82 | HPGD (0.54) | HPGDDAGLAABCG2NPC1RAB9A | |
| SCHEMBL512253 | 0.79 | HPGD (0.63) | HPGDABCG2NPC1RAB9AALDH1A1 | |
| SCHEMBL4412019 | 0.79 | HPGD (0.51) | HPGDDAGLAABCG2NPC1RAB9A | |
| SCHEMBL4414660 | 0.78 | HPGD (0.50) | HPGDDAGLAABCG2NPC1RAB9A | |
| SCHEMBL513770 | 0.78 | HPGD (0.57) | HPGDABCG2NPC1RAB9AALDH1A1 | |
| SCHEMBL4407303 | 0.78 | HPGD (0.57) | HPGDABCG2NPC1RAB9AALDH1A1 | |
| SCHEMBL4409336 | 0.77 | HPGD (0.49) | HPGDABCG2ABCB1KCNH2HSD11B1 | |
| SCHEMBL24658718 | 0.74 | HPGD (0.53) | HPGDABCG2NPC1RAB9AMAPT |
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-2016202894-A1 | METHOD OF CONVERTING ALCOHOL TO HALIDE | UNIVERSITAET DES SAARLANDES (DE) | 2016-12-22 | — | — | WO | disclosed |