Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT6A | Q92794 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31124 | 0.87 | CYP3A4 (0.58) | KAT6ACYP3A4CYP2C9CYP2E1CYP2A6 | |
| Hydrochloric Acid SCHEMBL8091091 | 0.84 | CYP3A4 (0.56) | KAT6ACYP3A4CYP2C9CYP2E1CYP2A6 | |
| Ammonia Solution, Strong SCHEMBL28465317 | 0.84 | CYP3A4 (0.56) | KAT6ACYP3A4CYP2C9CYP2E1CYP2A6 | |
| Hydrochloric Acid SCHEMBL27688178 | 0.84 | CYP3A4 (0.56) | KAT6ACYP3A4CYP2C9CYP2E1CYP2A6 | |
| Hydrogen Sulfide SCHEMBL27668457 | 0.84 | CYP3A4 (0.56) | KAT6ACYP3A4CYP2C9CYP2E1CYP2A6 | |
| SCHEMBL30163538 | 0.84 | CYP3A4 (0.56) | KAT6ACYP3A4CYP2C9CYP2E1CYP2A6 | |
| Sulfuric Acid SCHEMBL7056441 | 0.84 | KAT6A (0.49) | KAT6ACYP3A4CYP2C9CYP2E1CYP2A6 | |
| Phosphoric Acid SCHEMBL28563831 | 0.83 | CA12 (0.50) | KAT6ACYP3A4CYP2C9CYP2E1CYP2A6 | |
| SCHEMBL559934 | 0.82 | LTA4H (0.59) | CYP3A4CYP2C9CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL7058736 | 0.82 | LTA4H (0.59) | CYP3A4CYP2C9CYP2E1CYP2A6CYP2B6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109438277-A | Oximido naphthoquinone compound and its preparation method and application | 普济生物科技（台州）有限公司 | 2019-03-08 | — | — | CN | disclosed |
| CN-101817767-A | Substituted sulphonamide compound and preparation method, medicine composition and application thereof | SHANGHAI INST BIOL SCIENCES | 2010-09-01 | — | — | CN | disclosed |
| CN-101031564-A | Piperazine derivatives for the treatment of gastrointestinal disorders | GLAXO GROUP LTD (GB) | 2007-09-05 | — | — | CN | disclosed |