Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 12/20 | 0.74 |
| ▸ | CYP3A4 | P08684 | 12/20 | 0.74 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.74 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.74 |
| ▸ | AHR | P35869 | 2/20 | 0.74 |
| ▸ | NR1I3 | Q14994 | 2/20 | 0.74 |
| ▸ | VDR | P11473 | 1/20 | 0.74 |
| ▸ | CYP2D6 | P10635 | 10/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.69 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.69 |
| ▸ | USP2 | O75604 | 6/20 | 0.69 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.69 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.69 |
| ▸ | MAPT | P10636 | 2/20 | 0.66 |
| ▸ | ATM | Q13315 | 1/20 | 0.66 |
| ▸ | TSHR | P16473 | 8/20 | 0.65 |
| ▸ | LMNA | P02545 | 5/20 | 0.65 |
| ▸ | MEN1 | O00255 | 5/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL27694078 | 0.84 | CYP1A2 (0.72) | CYP1A2CYP3A4CYP2C9CYP2B6AHR | |
| SCHEMBL28196625 | 0.84 | CYP1A2 (0.72) | CYP1A2CYP3A4CYP2C9CYP2B6AHR | |
| SCHEMBL24393204 | 0.84 | AURKA (0.58) | CYP1A2CYP3A4CYP2C9CYP2B6AHR | |
| SCHEMBL16404287 | 0.83 | CYP1A2 (0.68) | CYP1A2CYP2C19MAPK1MAPTLMNA | |
| SCHEMBL20233980 | 0.83 | PDE10A (0.59) | CYP1A2CYP3A4CYP2C9CYP2B6AHR | |
| SCHEMBL26858214 | 0.82 | KMT2A (0.56) | CYP1A2CYP3A4CYP2C9CYP2B6AHR | |
| SCHEMBL16037634 | 0.82 | CYP1A2 (0.69) | CYP1A2CYP3A4CYP2C9CYP2B6AHR | |
| SCHEMBL17904147 | 0.81 | NR1I3 (0.68) | CYP1A2CYP3A4CYP2C9CYP2B6AHR | |
| SCHEMBL29712524 | 0.81 | CYP1A2 (0.67) | CYP1A2CYP3A4CYP2C9CYP2B6AHR | |
| SCHEMBL28315176 | 0.81 | CYP1A2 (0.67) | CYP1A2CYP3A4CYP2C9CYP2B6AHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-105327703-B | The preparation method of gold nano catalyst and the catalyst prod obtained and application | 中国科学技术大学 | 2017-11-24 | — | — | CN | disclosed |
| CN-105327703-A | Preparation method for gold nanometer catalyst, and obtained catalyst product and application thereof | USTC UNIV SCIENCE TECH CN | 2016-02-17 | — | — | CN | disclosed |