Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.83 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.83 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.83 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.83 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.83 |
| ▸ | MAPT | P10636 | 3/20 | 0.83 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.83 |
| ▸ | HPGD | P15428 | 2/20 | 0.83 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.83 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.83 |
| ▸ | PKM | P14618 | 1/20 | 0.83 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.83 |
| ▸ | GAA | P10253 | 3/20 | 0.70 |
| ▸ | GFER | P55789 | 1/20 | 0.70 |
| ▸ | IDO1 | P14902 | 7/20 | 0.68 |
| ▸ | RECQL | P46063 | 1/20 | 0.64 |
| ▸ | CES1 | P23141 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL20817457 | 0.91 | KDM4E (1.00) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9412377 | 0.87 | RECQL (0.64) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28403615 | 0.83 | ALDH1A1 (0.83) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7585555 | 0.82 | CES1 (0.81) | MAPTALDH1A1HPGDALOX12TDP1 | |
| SCHEMBL2136408 | 0.82 | CES1 (0.81) | MAPTALDH1A1HPGDALOX12TDP1 | |
| SCHEMBL11161395 | 0.82 | ALDH1A1 (1.00) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL29007531 | 0.80 | HPGD (0.87) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28429407 | 0.80 | ALDH1A1 (0.77) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL25862489 | 0.80 | CA1 (0.61) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28429355 | 0.79 | ALDH1A1 (0.75) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 |
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-108276305-B | Mild method for preparing Sudan red I structural analogue | 江西理工大学 | 2020-07-31 | — | — | CN | claimed |
| CN-111217725-B | Mild synthesis method of diaryl substituted benzenesulfonyl hydrazide | 江西理工大学 | 2022-04-26 | — | — | CN | disclosed |
| CN-108276305-B | Mild method for preparing Sudan red I structural analogue | 江西理工大学 | 2020-07-31 | — | — | CN | disclosed |
| CN-111217725-A | Mild synthesis method of diaryl substituted benzenesulfonyl hydrazide | 江西理工大学 | 2020-06-02 | — | — | CN | disclosed |