Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 5/20 | 0.64 |
| ▸ | ALPL | P05186 | 1/20 | 0.58 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.58 |
| ▸ | WDR5 | P61964 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.53 |
| ▸ | FABP4 | P15090 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28637913 | 0.91 | ACLY (0.63) | ACLYALPLTRIM24WDR5ALDH1A1 | |
| SCHEMBL28657533 | 0.91 | ACLY (0.53) | ACLYALPLTRIM24WDR5ALDH1A1 | |
| SCHEMBL28644506 | 0.88 | ALDH1A1 (0.53) | ACLYALPLTRIM24ALDH1A1HSD17B10 | |
| SCHEMBL28639303 | 0.88 | MCL1 (0.64) | ACLYALDH1A1HSD17B10PFKFB3MEN1 | |
| SCHEMBL9997390 | 0.87 | PFKFB3 (0.65) | ACLYTRIM24ALDH1A1HSD17B10PFKFB3 | |
| SCHEMBL28651873 | 0.86 | PFKFB3 (0.53) | ACLYALPLTRIM24ALDH1A1HSD17B10 | |
| SCHEMBL28637321 | 0.86 | PFKFB3 (0.62) | ACLYALDH1A1HSD17B10PFKFB3MEN1 | |
| SCHEMBL28647932 | 0.85 | ALDH1A1 (0.70) | ACLYALDH1A1HSD17B10PFKFB3MEN1 | |
| SCHEMBL28637063 | 0.84 | ALDH1A1 (0.58) | ACLYALDH1A1HSD17B10PFKFB3MEN1 | |
| SCHEMBL28639860 | 0.84 | ALDH1A1 (0.53) | ACLYALDH1A1HSD17B10PFKFB3MEN1 |
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-113396145-A | PFKFB3 inhibitors and uses thereof | 盖罗发现有限责任公司 | 2021-09-14 | — | — | CN | disclosed |