Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.33 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.32 |
| ▸ | HSD17B13 | Q7Z5P4 | 1/20 | 0.32 |
| ▸ | ACLY | P53396 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 2/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL30931019 | 0.83 | PTGS2 (0.36) | PAK1LMNAMAPTPTGS2 | |
| SCHEMBL30931143 | 0.76 | PTGS2 (0.35) | LMNAMAPTPTGS2 | |
| SCHEMBL27250279 | 0.75 | GRM1 (0.31) | — | |
| SCHEMBL24719683 | 0.75 | ALDH2 (0.35) | HSD17B13 | |
| SCHEMBL30931088 | 0.74 | RAB9A (0.36) | IDO1RPS6KA3PAK1ACLY | |
| SCHEMBL24719452 | 0.72 | ESR2 (0.36) | GSK3BRPS6KA3ACLYABCB1MAPT | |
| SCHEMBL24720655 | 0.72 | AKR1C3 (0.33) | HSD17B13 | |
| SCHEMBL24719482 | 0.72 | CAPN1 (0.42) | RPS6KA3HSD17B13 | |
| SCHEMBL30124212 | 0.72 | CAPN1 (0.42) | RPS6KA3HSD17B13 | |
| SCHEMBL24720609 | 0.72 | PTGES (0.34) | ACLY |
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-117794525-A | Anticancer compounds | 加利福尼亚大学董事会 | 2024-03-29 | — | — | CN | disclosed |