Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Tetrabuthylammonium SCHEMBL8611230 | 0.87 | KDM4E (0.55) | CYP3A4LMNAKMT2AMEN1MAPT | |
| Tetrabuthylammonium SCHEMBL23522674 | 0.87 | LMNA (0.48) | CYP3A4LMNAKMT2AMEN1MAPT | |
| Tetrabuthylammonium SCHEMBL106854 | 0.85 | TSHR (0.47) | CYP3A4LMNAKMT2AMEN1MAPT | |
| Tetrabuthylammonium SCHEMBL23539134 | 0.81 | TSHR (0.41) | CYP3A4LMNAKMT2AMEN1MAPT | |
| Tetrabuthylammonium SCHEMBL3702709 | 0.80 | TSHR (0.44) | CYP3A4LMNAKMT2AMEN1MAPT | |
| Salsalate SCHEMBL11218871 | 0.80 | KDM4E (0.52) | CYP3A4LMNAKMT2AMEN1MAPT | |
| Potassium Ion SCHEMBL8613654 | 0.79 | KDM4E (0.47) | KMT2AMEN1MAPTTSHRALDH1A1 | |
| Zinc Ion SCHEMBL23803713 | 0.79 | KDM4E (0.47) | KMT2AMEN1MAPTTSHRALDH1A1 | |
| SCHEMBL8612211 | 0.79 | KDM4E (0.52) | KMT2AMEN1MAPTTSHRMAPK1 | |
| Tetrabuthylammonium SCHEMBL107740 | 0.79 | KDM4E (0.59) | CYP3A4LMNAKMT2AMEN1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0658533-B1 | Process for the oxidation of primary and secondary alcohols to aldehydes and ketones and for the oxidation of 1,2-diols to alpha-ketols and alpha-diketones | SIGMA TAU IND FARMACEUTI (IT) | 1998-04-15 | — | — | EP | disclosed |
| US-5510538-A | USING O-IODOXYBENZOIC ACID AS OXIDIZING AGENT | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 1996-04-23 | — | — | US | disclosed |
| EP-0658533-A1 | Process for the oxidation of primary and secondary alcohols to aldehydes and ketones and for the oxidation of 1,2-diols to alpha-ketols and alpha-diketones | Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) | 1995-06-21 | — | — | EP | disclosed |