Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.69 |
| ▸ | RAB9A | P51151 | 9/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.69 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.64 |
| ▸ | TP53 | P04637 | 4/20 | 0.64 |
| ▸ | PKM | P14618 | 3/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.64 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.64 |
| ▸ | GUSB | P08236 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL19960365 | 0.89 | NPC1 (0.73) | NPC1RAB9AKDM4EALDH1A1GPR55 | |
| SCHEMBL19960368 | 0.86 | NPC1 (0.76) | NPC1RAB9AKDM4EALDH1A1GPR55 | |
| SCHEMBL19960367 | 0.85 | RAB9A (0.79) | NPC1RAB9AKDM4EALDH1A1GPR55 | |
| SCHEMBL19960380 | 0.82 | NPC1 (0.56) | NPC1RAB9AKDM4EALDH1A1GPR55 | |
| SCHEMBL29695905 | 0.81 | NPC1 (1.00) | NPC1RAB9AKDM4EALDH1A1GPR55 | |
| SCHEMBL162191 | 0.81 | NPC1 (1.00) | NPC1RAB9AKDM4EALDH1A1GPR55 | |
| SCHEMBL13406020 | 0.81 | DGAT1 (0.54) | NPC1RAB9AKDM4EALDH1A1GPR55 | |
| SCHEMBL7270947 | 0.80 | JAK2 (0.51) | NPC1RAB9AKDM4EALDH1A1GPR55 | |
| SCHEMBL172216 | 0.80 | NPC1 (1.00) | NPC1RAB9AKDM4EALDH1A1GPR55 | |
| SCHEMBL30561047 | 0.80 | NPC1 (1.00) | NPC1RAB9AKDM4EALDH1A1GPR55 |
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-2023084449-A1 | DIAMINOCYCLOPENTYLPYRIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE OR DISORDER | NOVARTIS AG (CH) | 2023-05-19 | — | — | WO | disclosed |