Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.36 |
| ▸ | SLC9A2 | Q9UBY0 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 5/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26257380 | 0.76 | SMN1; SMN2 (0.58) | SMN1; SMN2KDM4EALDH1A1HSD17B10KMT2A | |
| SCHEMBL24920804 | 0.71 | PDK2 (0.37) | PDK2SMN1; SMN2SLC9A1SLC9A2NPC1 | |
| SCHEMBL19649880 | 0.68 | JAK1 (0.66) | — | |
| SCHEMBL24920900 | 0.68 | PDK2 (0.35) | PDK2SLC9A1SLC9A2CYP3A4CYP2C9 | |
| SCHEMBL21905028 | 0.67 | CYP1A2 (0.37) | CYP3A4CYP2C9ALDH1A1HSD17B10CYP1A2 | |
| SCHEMBL24920813 | 0.67 | PDK2 (0.37) | PDK2SLC9A1SLC9A2CYP3A4CYP2C9 | |
| SCHEMBL24920808 | 0.67 | ALDH1A1 (0.38) | PDK2SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL18971462 | 0.66 | SMN1; SMN2 (0.36) | SMN1; SMN2KDM4EACACBALDH1A1HSD17B10 | |
| SCHEMBL18495603 | 0.66 | PDK2 (0.64) | PDK2SMN1; SMN2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL2511301 | 0.65 | QPCT (0.39) | CYP3A4CYP2C9ALDH1A1HSD17B10CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3856735-B1 | FUSED BICYCLIC HETEROCYCLES AS THERAPEUTIC AGENTS | UNIV NEW YORK (US) | 2023-09-06 | — | — | EP | disclosed |