Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL28604695 | 0.83 | ANPEP (0.35) | CYP2C19HPGD | |
| SCHEMBL28606804 | 0.81 | KMT2A (0.38) | ALDH1A1LMNAKMT2AMEN1POLB | |
| SCHEMBL18662607 | 0.80 | HTR6 (0.39) | ALDH1A1LMNAMAPTKMT2AMEN1 | |
| SCHEMBL28852707 | 0.80 | HTR6 (0.36) | ALDH1A1CYP2C19HPGD | |
| SCHEMBL29414040 | 0.80 | HTR6 (0.36) | ALDH1A1CYP2C19HPGD | |
| SCHEMBL19155187 | 0.78 | GAA (0.41) | NPC1ALDH1A1CYP2D6CYP2C19CYP1A2 | |
| SCHEMBL23668187 | 0.76 | DGAT1 (0.34) | ALDH1A1CYP2C19LMNAKMT2AHPGD | |
| SCHEMBL28473998 | 0.75 | MAPT (0.36) | CYP2C19MAPK1MAPTHPGD | |
| SCHEMBL23403834 | 0.74 | PDE4A (0.35) | RAB9AALDH1A1CYP2C19MAPT | |
| SCHEMBL19578381 | 0.74 | TDP1 (0.36) | NPC1ALDH1A1CYP2D6CYP2C19CYP1A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117924249-A | Preparation method of JAK1 inhibitor AZD4604 | 云南万宏医药科技有限公司 | 2024-04-26 | — | — | CN | claimed |
| CN-117924249-A | Preparation method of JAK1 inhibitor AZD4604 | 云南万宏医药科技有限公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-115925693-A | Selective inhibitors of JAK1 | 阿斯利康(瑞典)有限公司 | 2023-04-07 | — | — | CN | disclosed |
| CN-110461830-B | Selective inhibitors of JAK1 | 阿斯利康(瑞典)有限公司 | 2022-11-01 | — | — | CN | disclosed |
| CN-113166094-A | Novel compounds as protein kinase inhibitors and pharmaceutical compositions comprising the same | 怡诺安有限公司 | 2021-07-23 | — | — | CN | disclosed |