Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.60 |
| ▸ | RAB9A | P51151 | 5/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | FADS1 | O60427 | 1/20 | 0.58 |
| ▸ | CSF1R | P07333 | 1/20 | 0.58 |
| ▸ | KCNK3 | O14649 | 5/20 | 0.54 |
| ▸ | KCNK9 | Q9NPC2 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL23844180 | 0.91 | RAB9A (0.62) | NPC1RAB9AHTTFADS1KCNK3 | |
| SCHEMBL21133272 | 0.88 | FADS1 (0.58) | NPC1RAB9AHTTFADS1KCNK3 | |
| SCHEMBL8458801 | 0.88 | RXRA (0.59) | NPC1RAB9AHTTFADS1KCNK3 | |
| SCHEMBL8283426 | 0.88 | KCNK9 (0.69) | NPC1RAB9AGAAHTTFADS1 | |
| SCHEMBL9978845 | 0.87 | FADS1 (0.64) | NPC1RAB9AHTTFADS1KCNK3 | |
| SCHEMBL22629693 | 0.87 | KCNK3 (0.74) | NPC1RAB9AGAACSF1RKCNK3 | |
| SCHEMBL22628664 | 0.87 | MEN1 (0.71) | NPC1RAB9AFADS1KCNK3KCNK9 | |
| SCHEMBL24211467 | 0.87 | KCNK3 (0.62) | NPC1RAB9AFADS1KCNK3KCNK9 | |
| SCHEMBL23844177 | 0.86 | FADS1 (0.62) | NPC1RAB9AHTTFADS1KCNK3 | |
| SCHEMBL12228168 | 0.85 | RAB9A (0.71) | NPC1RAB9AKCNK3KCNK9MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1751136-A2 | NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER | AMGEN INC. (US) | 2007-02-14 | — | — | EP | claimed |
| WO-2005113494-A2 | NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER | AMGEN INC. (US) | 2005-12-01 | — | — | WO | claimed |
| US-20200369901-A1 | DISPERSION, INK JET RECORDING METHOD, RECORDED MATERIAL, AND COMPOUND | FUJIFILM CORPORATION (JP) | 2020-11-26 | — | — | US | disclosed |