Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | TYMP | P19971 | 1/20 | 0.40 |
| ▸ | GCGR | P47871 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SLC11A2 | P49281 | 1/20 | 0.38 |
| ▸ | CTSV | O60911 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9455077 | 0.98 | KEAP1 (0.49) | KEAP1NFE2L2TNKS2PTGS2TYMP | |
| SCHEMBL9269889 | 0.84 | PDGFRA (0.49) | TNKS2PTGS2SMN1; SMN2KDM4EPGR | |
| SCHEMBL9455121 | 0.84 | ALDH1A1 (0.46) | PTGS2ADORA1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL5100169 | 0.83 | SLC2A1 (0.48) | PTGS2MEN1KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL9269940 | 0.81 | SLC2A1 (0.49) | PTGS2MEN1KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL3398595 | 0.81 | LMNA (0.49) | KEAP1NFE2L2TNKS2PTGS2ADORA1 | |
| SCHEMBL9422608 | 0.80 | PDGFRA (0.51) | PTGS2SMN1; SMN2KDM4EMAPT | |
| SCHEMBL9454944 | 0.80 | MAPT (0.53) | TNKS2PTGS2SLC11A2MAPT | |
| SCHEMBL9454898 | 0.78 | ALDH1A1 (0.51) | PTGS2SMN1; SMN2KDM4EMAPT | |
| SCHEMBL9878971 | 0.78 | SLC2A1 (0.47) | KEAP1NFE2L2PTGS2TYMPMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5403934-A | Heterocyclic compounds | BURROUGHS WELLCOME CO. (US) | 1995-04-04 | — | — | US | disclosed |
| WO-1991013873-A1 | HETEROCYCLIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-09-19 | — | — | WO | disclosed |