Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 4/20 | 0.52 |
| ▸ | CTSK | P43235 | 3/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CTSH | P09668 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CTSC | P53634 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.50 |
| ▸ | CTSS | P25774 | 2/20 | 0.48 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.47 |
| ▸ | PSAT1 | Q9Y617 | 2/20 | 0.47 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | MME | P08473 | 2/20 | 0.46 |
| ▸ | ACE | P12821 | 2/20 | 0.46 |
| ▸ | CPA1 | P15085 | 2/20 | 0.46 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.46 |
| ▸ | ACACB | O00763 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 3/20 | 0.46 |
| ▸ | PPARA | Q07869 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10523997 | 0.91 | ANPEP (0.57) | ANPEPCTSKCTSCCTSSCTSB | |
| SCHEMBL433224 | 0.83 | ESR1 (0.58) | ANPEPCTSKCYP1A2CYP3A4CTSS | |
| SCHEMBL28384249 | 0.83 | ATM (0.46) | ANPEPCTSKACACBPPARGPPARA | |
| SCHEMBL11925791 | 0.82 | NLRP3 (0.47) | ANPEPCYP3A4CTSC | |
| SCHEMBL12321430 | 0.82 | CTSC (0.49) | ANPEPCTSCACACBPPARGPPARA | |
| SCHEMBL31474258 | 0.82 | NOS2 (0.48) | ANPEPCTSKCTSSPPARG | |
| SCHEMBL9788997 | 0.81 | TAS1R3 (0.46) | ANPEPACACBPPARGPPARA | |
| SCHEMBL10536462 | 0.79 | ALDH1A1 (0.47) | ANPEPHDAC1HDAC6CTSBACACB | |
| SCHEMBL6576829 | 0.78 | ALDH1A1 (0.55) | HDAC1HDAC6SRRPSAT1MME | |
| SCHEMBL8416993 | 0.77 | CYP3A4 (0.44) | ANPEPCYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3359522-B1 | PROCESS FOR PREPARATION OF N-BOC BIPHENYL ALANINOL | CHIRAL QUEST SUZHOU CO LTD (CN) | 2020-02-26 | — | — | EP | disclosed |