Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | CHKA | P35790 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | NCF1 | P14598 | 1/20 | 0.42 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.39 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL19778437 | 1.00 | LMNA (0.46) | LMNAHDAC6MC4RCHKAALDH1A1 | |
| SCHEMBL19778438 | 1.00 | LMNA (0.46) | LMNAHDAC6MC4RCHKAALDH1A1 | |
| SCHEMBL19778420 | 0.85 | LMNA (0.43) | LMNAHDAC6MC4RCHKAALDH1A1 | |
| SCHEMBL21286657 | 0.76 | LMNA (0.48) | LMNAHDAC6MC4RCHKAALDH1A1 | |
| SCHEMBL28661824 | 0.76 | ALDH1A1 (0.39) | LMNAALDH1A1CA2MAPT | |
| SCHEMBL28661825 | 0.76 | ALDH1A1 (0.39) | LMNAALDH1A1CA2MAPT | |
| SCHEMBL29472423 | 0.76 | ALDH1A1 (0.39) | LMNAALDH1A1CA2MAPT | |
| SCHEMBL4935512 | 0.76 | ALDH1A1 (0.39) | LMNAALDH1A1CA2MAPT | |
| SCHEMBL30239005 | 0.76 | ALDH1A1 (0.39) | LMNAALDH1A1CA2MAPT | |
| SCHEMBL29472453 | 0.75 | ALOX5 (0.45) | LMNAALDH1A1 |
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-3484882-B1 | ISO-CITRATE DEHYDROGENASE (IDH) INHIBITOR | ZHEJIANG METON PHARMACEUTICAL CO LTD (CN) | 2022-04-27 | — | — | EP | disclosed |