Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11501531 | 0.86 | NPC1 (0.47) | NPC1RAB9ACA12CA9ALDH1A1 | |
| SCHEMBL13134912 | 0.76 | NPC1 (0.66) | NPC1RAB9ACA12CA9ALDH1A1 | |
| SCHEMBL11024878 | 0.74 | ALDH1A1 (0.49) | CA12CA9ALDH1A1TSHRKMT2A | |
| SCHEMBL11501967 | 0.73 | ALDH1A1 (0.41) | NPC1RAB9AALDH1A1TSHRKMT2A | |
| SCHEMBL11572722 | 0.72 | CYP2C19 (0.43) | NPC1RAB9ACA12CA9ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11786759 | 0.71 | NPC1 (0.70) | NPC1RAB9ACA12CA9ALDH1A1 | |
| SCHEMBL28295865 | 0.71 | LMNA (0.57) | NPC1RAB9ACA12CA9ALDH1A1 | |
| SCHEMBL11571982 | 0.69 | NPC1 (0.43) | NPC1RAB9ACA12CA9ALDH1A1 | |
| Bicarbonate SCHEMBL14811027 | 0.69 | ALDH1A1 (0.81) | NPC1RAB9ACA12CA9ALDH1A1 | |
| Bicarbonate SCHEMBL4671806 | 0.69 | ALDH1A1 (0.81) | NPC1RAB9ACA12CA9ALDH1A1 |
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-4151353-A | INSECTICIDE AND MITICIDE INTERMEDIATES | UNION CARBIDE CORPORATION (US) | 1979-04-24 | — | — | US | disclosed |