Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11215631 | 0.83 | ALOX5 (0.70) | ALOX5PTGS2ELANECTSG | |
| SCHEMBL28942906 | 0.82 | ELANE (0.54) | GABRA1GABRB2KDM4EALDH1A1LMNA | |
| SCHEMBL11215632 | 0.81 | ELANE (0.55) | GABRA1GABRB2KDM4EALDH1A1LMNA | |
| SCHEMBL9576160 | 0.80 | ALOX5 (0.66) | GABRA1GABRB2KDM4EALDH1A1LMNA | |
| SCHEMBL3581544 | 0.80 | ATM (0.49) | KDM4ELMNAMAPTHPGDALOX15 | |
| SCHEMBL3952889 | 0.80 | GABRA1 (0.64) | GABRA1GABRB2ALDH1A1LMNA | |
| SCHEMBL11830563 | 0.79 | CA12 (0.56) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL3990467 | 0.78 | GABRA1 (0.56) | GABRA1GABRB2KDM4EALDH1A1LMNA | |
| SCHEMBL6665474 | 0.78 | CALM1 (0.46) | KDM4EALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11732941 | 0.78 | MEN1 (0.43) | KDM4EALDH1A1MAPTHPGDALOX12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0036502-B1 | 2-ALKYL-5-HYDROXY-1,4-NAPHTHOQUINONES, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING THESE COMPOUNDS | ZYMA GMBH (DE) | 1983-10-19 | — | — | EP | disclosed |
| EP-0036502-A1 | 2-Alkyl-5-hydroxy-1,4-naphthoquinones, process for their manufacture and pharmaceutical preparations containing these compounds | ZYMA GMBH (DE) | 1981-09-30 | — | — | EP | disclosed |