Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.70 |
| ▸ | NPC1 | O15118 | 1/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | CNR2 | P34972 | 3/20 | 0.54 |
| ▸ | BCHE | P06276 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL28495436 | 0.95 | KMT2A (0.64) | KMT2ANPC1CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL20436788 | 0.93 | KMT2A (0.65) | KMT2ANPC1CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL20436785 | 0.90 | KMT2A (0.77) | KMT2ANPC1CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL7244502 | 0.89 | ALDH1A1 (0.67) | KMT2ANPC1CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL3241520 | 0.86 | LOX (0.54) | KMT2ANPC1ALDH1A1CA12L3MBTL1 | |
| SCHEMBL29007589 | 0.83 | MMP13 (0.57) | KMT2ANPC1CA12CA9LOX | |
| SCHEMBL16273105 | 0.82 | KMT2A (0.71) | KMT2ANPC1CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL27773636 | 0.82 | KMT2A (0.66) | KMT2ANPC1CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL13969733 | 0.82 | KMT2A (0.66) | KMT2ANPC1CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL28619353 | 0.82 | KMT2A (1.00) | KMT2ANPC1CYP3A4ALDH1A1CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116162046-A | Alkynyl sulfone derivative and preparation method and application thereof | 云南民族大学 | 2023-05-26 | — | — | CN | disclosed |
| US-6727294-B2 | RADIATION TRANSPARENT MOLDING MATERIALS | MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) | 2004-04-27 | — | — | US | disclosed |
| CN-1130358-C | Imidazole compound and preparation method and application thereof | SMITHKLINE BEECHAM CORP (US) | 2003-12-10 | — | — | CN | disclosed |
| US-20010034419-A1 | Radiation transparent molding materials | MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) | 2001-10-25 | — | — | US | disclosed |