Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAM | P19021 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | TNKS | O95271 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6661240 | 1.00 | PAM (0.52) | PAMNPC1RAB9AALDH1A1HAO1 | |
| SCHEMBL27835867 | 0.85 | HTT (0.49) | PAMNPC1RAB9AALDH1A1HAO1 | |
| SCHEMBL27502891 | 0.82 | NPC1 (0.46) | PAMNPC1RAB9AALDH1A1HAO1 | |
| Hydrochloric Acid SCHEMBL27503547 | 0.80 | NPC1 (0.45) | PAMNPC1RAB9AALDH1A1HAO1 | |
| SCHEMBL27397478 | 0.80 | NPC1 (0.45) | PAMNPC1RAB9AALDH1A1HAO1 | |
| SCHEMBL10458424 | 0.79 | SMN1; SMN2 (0.55) | NPC1RAB9AALDH1A1LMNAMAPT | |
| SCHEMBL27512110 | 0.77 | EGFR (0.43) | NPC1RAB9AALDH1A1HAO1MAPT | |
| (Z)-1,2-Diphenylethene SCHEMBL9472716 | 0.76 | PAM (0.61) | PAMNPC1RAB9AALDH1A1HAO1 | |
| (Z)-1,2-Diphenylethene SCHEMBL9472712 | 0.76 | PAM (0.61) | PAMNPC1RAB9AALDH1A1HAO1 | |
| (Z)-1,2-Diphenylethene SCHEMBL27882841 | 0.76 | PAM (0.61) | PAMNPC1RAB9AALDH1A1HAO1 |
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-2004007417-A1 | ENZYME INHIBITORS | THE AUSTRALIAN NATIONAL UNIVERSITY (AU) | 2004-01-22 | — | — | WO | disclosed |