Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | NPBWR1 | P48145 | 5/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23168775 | 0.84 | MAPT (0.43) | MAPTCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL23168772 | 0.81 | MAPT (0.43) | MAPTCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL29821968 | 0.75 | ALOX12 (0.40) | MAPTCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL23168931 | 0.74 | NPBWR1 (0.46) | MAPTLMNANPBWR1MCHR1TP53 | |
| SCHEMBL23168827 | 0.74 | THRB (0.54) | — | |
| SCHEMBL23168932 | 0.73 | NPBWR1 (0.43) | MAPTLMNAALDH1A1KDM4ENPBWR1 | |
| SCHEMBL29822193 | 0.73 | MEN1 (0.52) | MAPTCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL23168941 | 0.72 | THRB (0.38) | MAPTCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL23168940 | 0.72 | MAPT (0.40) | MAPTLMNATP53KMT2A | |
| SCHEMBL24820993 | 0.72 | MKNK1 (0.42) | MAPTCYP3A4CYP2D6CYP2C9CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021057791-A1 | CHEMICAL COMPOUND AS THYROID HORMONE BETA RECEPTOR AGONIST AND USE THEREOF | 广东东阳光药业有限公司 | 2021-04-01 | — | — | WO | disclosed |