Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ANPEP | P15144 | 4/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MRE11 | P49959 | 1/20 | 0.41 |
| ▸ | PTPRB | P23467 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | FAP | Q12884 | 1/20 | 0.38 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.38 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.38 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.38 |
| ▸ | MIF | P14174 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27548183 | 0.87 | SMN1; SMN2 (0.44) | ATML3MBTL1ACACBCTSLCTSK | |
| SCHEMBL433224 | 0.87 | ESR1 (0.58) | ANPEPESR1ESR2CTSLCTSK | |
| SCHEMBL31474258 | 0.86 | NOS2 (0.48) | ANPEPESR1ESR2CTSKMAPK1 | |
| SCHEMBL12321430 | 0.86 | CTSC (0.49) | L3MBTL1ANPEPESR1ESR2ACACB | |
| SCHEMBL11925791 | 0.86 | NLRP3 (0.47) | ANPEPESR1ESR2MAPK1MRE11 | |
| SCHEMBL10523997 | 0.85 | ANPEP (0.57) | ATML3MBTL1ANPEPCTSLCTSK | |
| SCHEMBL9788997 | 0.84 | TAS1R3 (0.46) | ANPEPESR1ESR2ACACBMAPK1 | |
| SCHEMBL21763387 | 0.83 | ANPEP (0.52) | ANPEPACACBCTSKPPARGPPARA | |
| SCHEMBL10536462 | 0.83 | ALDH1A1 (0.47) | L3MBTL1ANPEPESR1ESR2ACACB | |
| SCHEMBL10267032 | 0.81 | PPARG (0.44) | ESR1ACACBCTSLCTSKMRE11 |
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-106191147-B | Preparation method of chiral β -amino acid | 凯莱英医药集团（天津）股份有限公司 | 2020-03-27 | — | — | CN | disclosed |