Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 9/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | ATM | Q13315 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 5/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25146984 | 0.95 | KDM4E (0.39) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL25147537 | 0.90 | ALDH1A1 (0.35) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL25146986 | 0.90 | ALDH1A1 (0.35) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL19247013 | 0.90 | TSHR (0.45) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL19247965 | 0.89 | ALDH1A1 (0.43) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL19247017 | 0.89 | ALDH1A1 (0.43) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL25147398 | 0.89 | ALDH1A1 (0.38) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL25147395 | 0.88 | ALDH1A1 (0.35) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL24278999 | 0.86 | TSHR (0.39) | ALDH1A1TSHRHPGDMAPTKMT2A | |
| SCHEMBL19248039 | 0.85 | TSHR (0.43) | ALDH1A1TSHRHPGDMAPTKMT2A |
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-2023061998-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2023-04-20 | — | — | WO | disclosed |