Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | AKT2 | P31751 | 1/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 4/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | BRD2 | P25440 | 1/20 | 0.33 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL31190917 | 0.89 | GRM2 (0.39) | AKT1AKT2GRM2MAPTNPSR1 | |
| SCHEMBL31190904 | 0.84 | AKT1 (0.41) | AKT1AKT2GRM2KCNH2NPC1 | |
| SCHEMBL31190889 | 0.81 | GRM2 (0.42) | AKT1AKT2GRM2KCNH2NPC1 | |
| SCHEMBL31190905 | 0.81 | DGAT2 (0.42) | AKT1AKT2GRM2KDM4EALDH1A1 | |
| SCHEMBL31091955 | 0.78 | AKT1 (0.35) | AKT1AKT2GRM2KCNH2KDM4E | |
| SCHEMBL31190886 | 0.77 | AKT1 (0.42) | AKT1AKT2GRM2KCNH2NPC1 | |
| SCHEMBL31091885 | 0.77 | AKT1 (0.34) | AKT1AKT2GRM2KCNH2KDM4E | |
| SCHEMBL31091865 | 0.77 | AKT1 (0.36) | AKT1AKT2GRM2KCNH2NPC1 | |
| SCHEMBL31190897 | 0.76 | SUV39H2 (0.41) | GRM2NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL31298287 | 0.75 | CSNK1D (0.38) | AKT1AKT2KDM4EALDH1A1SMN1; SMN2 |
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-2024220543-A1 | NK3 MODULATORS AND USES THEREOF | KALLYOPE, INC. (US) | 2024-10-24 | — | — | WO | disclosed |