Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 4/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19971094 | 0.81 | CYP4F2 (0.50) | KMT2ATDP1ALDH1A1CYP4F2CYP4A11 | |
| SCHEMBL24327190 | 0.79 | CYP4F2 (0.53) | KMT2ATDP1ALDH1A1CYP4F2CYP4A11 | |
| Hydrochloric Acid SCHEMBL28509639 | 0.77 | CYP4F2 (0.52) | KMT2ATDP1ALDH1A1CYP4F2CYP4A11 | |
| Phenol SCHEMBL8333389 | 0.77 | CA2 (0.65) | MAPTKMT2ACA12CA1CA2 | |
| Phenol SCHEMBL27673835 | 0.77 | CA2 (0.65) | MAPTKMT2ACA12CA1CA2 | |
| SCHEMBL12505244 | 0.76 | KMT2A (0.52) | MAPTKMT2AKIF11CHRM2CHRM1 | |
| Phenol SCHEMBL28224533 | 0.75 | MAPT (0.54) | MAPTKMT2ACA12CA1CA2 | |
| SCHEMBL28208793 | 0.75 | LMNA (0.51) | MAPTKMT2ATDP1ALDH1A1LMNA | |
| 1,5-Pentanediol SCHEMBL28576759 | 0.74 | TDP1 (0.61) | KMT2ACA12CA1CA2GLA | |
| 1,6-Hexanediol SCHEMBL28557265 | 0.74 | TDP1 (0.61) | KMT2ACA12CA1CA2GLA |
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 |
|---|---|---|---|---|---|---|---|
| CN-115916194-A | Methods for delaying, preventing and treating acquired resistance to RAS inhibitors | 锐新医药公司 | 2023-04-04 | — | — | CN | disclosed |
| CN-107849015-B | Benzimidazole derivatives as PAD4 inhibitors | 葛兰素知识产权发展有限公司 | 2021-03-19 | — | — | CN | disclosed |