Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TERT | O14746 | 1/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | AXL | P30530 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | SNCA | P37840 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 2/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7879959 | 0.78 | BRD4 (0.56) | TERTAPPPDE3BPDE3AMAPT | |
| SCHEMBL4553044 | 0.74 | AR (0.51) | TERTAPPPDE3BPDE3AMAPT | |
| SCHEMBL30807019 | 0.74 | DAO (0.55) | CYP2A6KEAP1AXLMAPTALDH1A1 | |
| SCHEMBL890079 | 0.74 | DAO (0.55) | CYP2A6KEAP1AXLMAPTALDH1A1 | |
| SCHEMBL17324784 | 0.73 | CFTR (0.47) | TERTAPPMAPTALOX15HSD17B10 | |
| SCHEMBL30180701 | 0.73 | EIF4A3 (0.58) | MAPTALDH1A1TSHRALOX15HSD17B10 | |
| SCHEMBL3602545 | 0.73 | EIF4A3 (0.58) | MAPTALDH1A1TSHRALOX15HSD17B10 | |
| SCHEMBL614723 | 0.71 | LMNA (0.56) | CYP2A6KEAP1ALDH1A1TSHRALOX15 | |
| SCHEMBL475358 | 0.71 | LMNA (0.52) | CYP2A6KEAP1AXLALDH1A1ITK | |
| SCHEMBL8529940 | 0.71 | CYP2A6 (0.44) | APPCYP2A6KEAP1AXLMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023011416-A1 | MULTI-TARGET INHIBITOR TARGETING HDAC AND NAD SYNTHESIS AND USE OF MULTI-TARGET INHIBITOR | 中国海洋大学 | 2023-02-09 | — | — | WO | disclosed |
| EP-3321261-A1 | HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES | Curis, Inc. (US) | 2018-05-16 | — | — | EP | disclosed |