Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | JAK3 | P52333 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15573465 | 0.78 | ALDH1A1 (0.42) | KDM4EALDH1A1GAAJAK3LMNA | |
| SCHEMBL22449359 | 0.77 | ALDH1A1 (0.64) | KDM4EALDH1A1GAAGRM5CYP2C19 | |
| SCHEMBL7850737 | 0.76 | KDM4E (0.63) | KDM4EALDH1A1GAALMNATSHR | |
| SCHEMBL15573464 | 0.76 | JAK3 (0.40) | KDM4EALDH1A1GAAJAK3P2RX7 | |
| SCHEMBL28738249 | 0.74 | PKM (0.45) | KDM4EALDH1A1GAAP2RX7PKM | |
| SCHEMBL2240328 | 0.73 | L3MBTL1 (0.47) | KDM4EALDH1A1P2RX7PDE10ACYP2C19 | |
| SCHEMBL5729067 | 0.73 | NPC1 (0.58) | ALDH1A1P2RX7CYP2C19TSHR | |
| SCHEMBL29143411 | 0.72 | ESR1 (0.41) | KDM4EALDH1A1GAAPDE10ACYP2C19 | |
| SCHEMBL24291941 | 0.71 | RIPK1 (0.45) | KDM4EALDH1A1P2RX7TSHRSLC18A3 | |
| SCHEMBL4458878 | 0.71 | PKM (0.58) | ALDH1A1GAAGRM5LMNAPKM |
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-2019027058-A1 | HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2019-02-07 | — | — | WO | disclosed |