Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.71 |
| ▸ | RAB9A | P51151 | 6/20 | 0.71 |
| ▸ | LMNA | P02545 | 3/20 | 0.71 |
| ▸ | TP53 | P04637 | 2/20 | 0.71 |
| ▸ | HTT | P42858 | 2/20 | 0.71 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.71 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.71 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.71 |
| ▸ | RELA | Q04206 | 1/20 | 0.71 |
| ▸ | PNLIP | P16233 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 4/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | POLB | P06746 | 3/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | AR | P10275 | 1/20 | 0.53 |
| ▸ | CBR1 | P16152 | 1/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | PLG | P00747 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5403431 | 0.84 | PNLIP (0.68) | NPC1RAB9ALMNATP53HTT | |
| SCHEMBL5079177 | 0.83 | RAB9A (1.00) | NPC1RAB9ALMNATP53HTT | |
| SCHEMBL7058035 | 0.79 | RAB9A (0.79) | NPC1RAB9ALMNATP53HTT | |
| SCHEMBL1961876 | 0.79 | NPC1 (0.68) | NPC1RAB9ALMNATP53HTT | |
| SCHEMBL20413311 | 0.78 | NPC1 (0.67) | NPC1RAB9ALMNATP53HTT | |
| SCHEMBL7183238 | 0.78 | RAB9A (0.67) | NPC1RAB9ALMNATP53HTT | |
| SCHEMBL9976436 | 0.77 | RAB9A (0.64) | NPC1RAB9ALMNATP53HTT | |
| SCHEMBL10880537 | 0.76 | TDP1 (0.58) | NPC1RAB9ALMNATP53HTT | |
| Acetaminophen SCHEMBL27938115 | 0.76 | ALDH1A1 (0.59) | NPC1RAB9ALMNATP53HTT | |
| SCHEMBL5742618 | 0.76 | RAB9A (0.68) | NPC1RAB9ALMNATP53HTT |
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-RE43481-E1 | Diazepan derivatives or salts thereof | ASTELLAS PHARMA INC. (JP) | 2012-06-19 | — | — | US | disclosed |