Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | ALPL | P05186 | 1/20 | 0.52 |
| ▸ | ALPI | P09923 | 1/20 | 0.52 |
| ▸ | ALPG | P10696 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL13652543 | 0.86 | NPC1 (0.61) | NPC1RAB9ANR1H4LMNAALDH1A1 | |
| SCHEMBL3845087 | 0.82 | ALDH1A1 (0.68) | NPC1RAB9ALMNAALDH1A1POLB | |
| SCHEMBL5322177 | 0.81 | NPC1 (0.62) | NPC1RAB9ANR1H4LMNAALDH1A1 | |
| SCHEMBL22060073 | 0.81 | NPC1 (0.62) | NPC1RAB9ANR1H4LMNAALDH1A1 | |
| SCHEMBL17343668 | 0.81 | ALDH1A1 (0.62) | NPC1RAB9ANR1H4LMNAALDH1A1 | |
| SCHEMBL20794904 | 0.80 | LMNA (0.65) | NPC1RAB9ANR1H4LMNAALDH1A1 | |
| SCHEMBL11146344 | 0.79 | NPC1 (0.57) | NPC1RAB9ANR1H4LMNAALDH1A1 | |
| SCHEMBL28396081 | 0.78 | MAPK14 (0.59) | NPC1RAB9ALMNAALDH1A1PKM | |
| SCHEMBL1948433 | 0.78 | ALDH1A1 (0.64) | NPC1RAB9ALMNAALDH1A1HTT | |
| SCHEMBL11154663 | 0.77 | POLB (0.61) | NPC1RAB9ALMNAALDH1A1POLB |
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-4398944-A | N-ALKOXYPHENYLMETHYL-2-CHLOROACETAMIDE | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1983-08-16 | — | — | US | claimed |