Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A2 | Q05940 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28856518 | 0.94 | SLC18A2 (0.34) | SLC18A2CYP1A2CYP2C19MAPTPKM | |
| SCHEMBL28856544 | 0.80 | MAPT (0.34) | CYP1A2CYP2C19MAPTTSHRPKM | |
| SCHEMBL28856540 | 0.76 | ALDH1A1 (0.34) | MAPTTSHRKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL28856479 | 0.70 | MAPT (0.34) | CYP1A2CYP2C19MAPTTSHRPKM | |
| SCHEMBL28856511 | 0.69 | CA1 (0.35) | CYP1A2CYP2C19MAPTTSHRPKM | |
| SCHEMBL28856536 | 0.68 | CYP1A2 (0.35) | CYP1A2CYP2C19MAPTTSHRPKM | |
| SCHEMBL28856526 | 0.67 | MAPT (0.32) | CYP1A2CYP2C19MAPTTSHRPKM | |
| SCHEMBL28856487 | 0.66 | GRM2 (0.31) | — | |
| SCHEMBL28856476 | 0.64 | CA1 (0.42) | MAPTTSHRPKMALDH1A1KMT2A | |
| SCHEMBL29352142 | 0.62 | CNR2 (0.39) | MAPTSMN1; SMN2NPC1RAB9AALDH1A1 |
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-109608432-B | Thiophene derivatives as URAT1 inhibitors | 江苏艾立康医药科技有限公司 | 2022-10-11 | — | — | CN | disclosed |