Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | VDR | P11473 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 8/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1603062 | 1.00 | CYP1A2 (0.50) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR | |
| SCHEMBL27034493 | 0.90 | CYP1A2 (0.44) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR | |
| SCHEMBL8381741 | 0.88 | NPSR1 (0.65) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR | |
| Tolnidamine SCHEMBL1604178 | 0.80 | CYP1A2 (0.78) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR | |
| SCHEMBL927783 | 0.79 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR | |
| SCHEMBL27800001 | 0.79 | CYP1A2 (0.48) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR | |
| SCHEMBL1603498 | 0.77 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR | |
| SCHEMBL1603367 | 0.77 | TSHR (0.49) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR | |
| SCHEMBL29562389 | 0.77 | TSHR (0.49) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR | |
| SCHEMBL29562298 | 0.77 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2C9CYP2D6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3990433-A1 | PROCESSES OF MAKING 2-((1-BENZYL-1H-INDAZOL-3-YL)METHOXY)-2-METHYLPROPANOIC ACID AND ITS DERIVATIVES | Translatum Medicus Inc. (CA) | 2022-05-04 | — | — | EP | disclosed |