Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18180493 | 0.88 | P2RY12 (0.39) | KEAP1NFE2L2P2RY12CA12CYP1A2 | |
| SCHEMBL18180216 | 0.88 | KMT2A (0.40) | KEAP1NFE2L2P2RY12BCHEACHE | |
| SCHEMBL18180198 | 0.79 | CYP11B1 (0.52) | CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL14367311 | 0.78 | NPC1 (0.41) | CYP3A4L3MBTL1MEN1MAPTKMT2A | |
| SCHEMBL1714565 | 0.75 | SMN1; SMN2 (0.41) | CA12CYP1A2CYP3A4MEN1MAPT | |
| SCHEMBL1715299 | 0.75 | TSHR (0.44) | CYP1A2L3MBTL1MEN1MAPTKMT2A | |
| SCHEMBL11373381 | 0.73 | SMN1; SMN2 (0.40) | KEAP1NFE2L2CYP1A2CYP3A4MEN1 | |
| SCHEMBL27618647 | 0.73 | SMN1; SMN2 (0.40) | CA12CYP1A2CYP3A4MEN1MAPT | |
| SCHEMBL15455882 | 0.72 | AR (0.40) | KEAP1NFE2L2CA12CYP1A2CYP3A4 | |
| SCHEMBL11364194 | 0.71 | NPC1 (0.38) | KEAP1NFE2L2CYP1A2CYP3A4CA9 |
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-2016169514-A1 | IMIDAZOLE COMPOUND | 广东众生药业股份有限公司 | 2016-10-27 | — | — | WO | disclosed |