Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 9/20 | 0.37 |
| ▸ | CTSS | P25774 | 4/20 | 0.37 |
| ▸ | CTSK | P43235 | 4/20 | 0.37 |
| ▸ | CTSB | P07858 | 3/20 | 0.37 |
| ▸ | ACE | P12821 | 2/20 | 0.31 |
| ▸ | MME | P08473 | 1/20 | 0.31 |
| ▸ | CPA1 | P15085 | 1/20 | 0.31 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | ANPEP | P15144 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL25192767 | 0.79 | MAPT (0.38) | CTSLCTSSCTSKCTSBALDH1A1 | |
| SCHEMBL28544862 | 0.76 | CTSL (0.38) | CTSLCTSSCTSKCTSBALDH1A1 | |
| SCHEMBL5492156 | 0.74 | TRPA1 (0.42) | ALDH1A1RAB9APGRADRA2AADRA2B | |
| SCHEMBL28215676 | 0.73 | CA12 (0.44) | ALDH1A1 | |
| SCHEMBL268147 | 0.73 | — | — | |
| SCHEMBL268075 | 0.73 | — | — | |
| SCHEMBL28911205 | 0.73 | CTSL (0.36) | CTSLCTSSCTSKCTSBALDH1A1 | |
| SCHEMBL161152 | 0.70 | NR4A2 (0.38) | CTSLCTSSCTSKCTSBALDH1A1 | |
| SCHEMBL1886071 | 0.70 | SLC6A2 (0.40) | MMEALDH1A1RAB9A | |
| SCHEMBL13159378 | 0.69 | TRPA1 (0.51) | ALDH1A1TRPA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113996276-A | Solid phase extraction material and preparation method and application thereof | 南京大学 | 2022-02-01 | — | — | CN | claimed |
| CN-113996276-B | Solid phase extraction material and preparation method and application thereof | 南京大学 | 2022-05-17 | — | — | CN | disclosed |
| CN-113996276-A | Solid phase extraction material and preparation method and application thereof | 南京大学 | 2022-02-01 | — | — | CN | disclosed |