Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.65 |
| ▸ | CA1 | P00915 | 2/20 | 0.64 |
| ▸ | CA2 | P00918 | 2/20 | 0.64 |
| ▸ | CA5A | P35218 | 2/20 | 0.64 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.64 |
| ▸ | CA12 | O43570 | 1/20 | 0.64 |
| ▸ | CA9 | Q16790 | 1/20 | 0.64 |
| ▸ | FLT3 | P36888 | 1/20 | 0.61 |
| ▸ | KEAP1 | Q14145 | 9/20 | 0.57 |
| ▸ | NFE2L2 | Q16236 | 9/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | CASP3 | P42574 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.52 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28338995 | 0.86 | MIF (0.56) | PTGS2PTGS1CA1CA2CA5A | |
| SCHEMBL28964572 | 0.86 | MIF (0.56) | PTGS2PTGS1CA1CA2CA5A | |
| SCHEMBL21814340 | 0.86 | KEAP1 (0.73) | PTGS2PTGS1CA1CA2CA5A | |
| SCHEMBL13453289 | 0.85 | FLT3 (0.81) | PTGS2PTGS1CA1CA2CA5A | |
| SCHEMBL27933358 | 0.84 | KEAP1 (0.77) | PTGS2PTGS1CA1CA2CA5A | |
| SCHEMBL22897927 | 0.80 | CA1 (0.54) | PTGS2PTGS1CA1CA2CA5A | |
| SCHEMBL27340987 | 0.79 | HTT (0.59) | PTGS2KEAP1NFE2L2NPC1LMNA | |
| SCHEMBL29272648 | 0.79 | KEAP1 (0.64) | PTGS2PTGS1CA1CA2CA5A | |
| SCHEMBL19757166 | 0.78 | KEAP1 (0.49) | CA1CA2CA5ACA5BCA9 | |
| SCHEMBL18031103 | 0.78 | FLT3 (0.69) | PTGS2PTGS1CA1CA2CA5A |
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 |
|---|---|---|---|---|---|---|---|
| CN-117342969-A | (E) -alpha, beta-unsaturated amide derivative, preparation method and application thereof | 昆明理工大学 | 2024-01-05 | — | — | CN | disclosed |