Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | ELOVL1 | Q9BW60 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 2/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6971231 | 0.79 | CYP2C9 (0.46) | CYP2C9GAAMAPTHTTTSHR | |
| SCHEMBL19119923 | 0.77 | GRM5 (0.40) | HSD17B10ALDH1A1SMN1; SMN2 | |
| SCHEMBL16202040 | 0.76 | ALDH1A1 (0.36) | GAAMAPTALDH1A1NPC1 | |
| SCHEMBL5823369 | 0.76 | ABCB11 (0.51) | CYP2C9GAAMAPTHTTTSHR | |
| SCHEMBL7757989 | 0.76 | CYP2C9 (0.43) | CYP2C9GAAMAPTHTTTSHR | |
| SCHEMBL28013624 | 0.74 | ABCB11 (0.43) | CYP2C9GAAMAPTHTTTSHR | |
| SCHEMBL8953901 | 0.72 | CASR (0.44) | CYP2C9GAAMAPTHTTTSHR | |
| SCHEMBL27377814 | 0.71 | CYP2C9 (0.44) | CYP2C9GAAMAPTHTTTSHR | |
| SCHEMBL7692506 | 0.71 | CYP2C9 (0.44) | CYP2C9GAAMAPTHTTTSHR | |
| SCHEMBL13495377 | 0.71 | GAA (0.42) | CYP2C9GAAMAPTHTTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-110494434-A | Pyrazolo chlorobenzene based compound, its composition and its application method | HOFFMANN LA ROCHE | 2019-11-22 | — | — | CN | disclosed |