Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
| ▸ | TYK2 | P29597 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30661266 | 0.74 | ALDH1A1 (0.33) | ALDH1A1PKMRAB9A | |
| SCHEMBL30468453 | 0.71 | — | — | |
| SCHEMBL12844001 | 0.70 | CYP2A6 (0.32) | MAPTALDH1A1LMNAPKMMAPK1 | |
| SCHEMBL24424614 | 0.69 | MAPK1 (0.39) | MAPTALDH1A1LMNAPKMMAPK1 | |
| SCHEMBL30468441 | 0.67 | HDAC3 (0.36) | ALDH1A1LMNA | |
| SCHEMBL24367867 | 0.67 | HDAC3 (0.36) | ALDH1A1LMNA | |
| SCHEMBL31360488 | 0.67 | ALDH1A1 (0.31) | MAPTALDH1A1LMNAPKMMAPK1 | |
| SCHEMBL20041949 | 0.66 | CYP11B1 (0.31) | MAPTALDH1A1LMNAPKMMAPK1 | |
| SCHEMBL14647331 | 0.66 | CYP11B1 (0.31) | MAPTALDH1A1LMNAPKMMAPK1 | |
| SCHEMBL27964368 | 0.66 | ALDH1A1 (0.44) | ALDH1A1LMNAMAPK1RAB9ANPSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117043163-A | Pyrrolopyrimidine or pyrrolopyridine derivative and medical application thereof | 希格生科（深圳）有限公司 | 2023-11-10 | — | — | CN | disclosed |
| CN-116332910-A | 2-aminopyrimidine derivatives as kinase inhibitors, preparation and use thereof | 江苏威凯尔医药科技有限公司 | 2023-06-27 | — | — | CN | disclosed |