Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 3/20 | 0.48 |
| ▸ | CTSK | P43235 | 3/20 | 0.48 |
| ▸ | CTSS | P25774 | 2/20 | 0.48 |
| ▸ | CTSL | P07711 | 2/20 | 0.48 |
| ▸ | CPB1 | P15086 | 2/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4417131 | 0.82 | CASP3 (0.53) | CTSBCTSKCTSSCTSLCPB1 | |
| SCHEMBL20064375 | 0.81 | ALDH1A1 (0.58) | CTSBCTSKCTSLEPHX1ALDH1A1 | |
| SCHEMBL4406666 | 0.80 | CTSB (0.47) | CTSBCTSKCTSSCTSLCPB1 | |
| SCHEMBL4406670 | 0.80 | CTSB (0.47) | CTSBCTSKCTSSCTSLCPB1 | |
| SCHEMBL6612597 | 0.79 | EPHX1 (0.63) | CTSBCTSKCTSSCTSLCPB1 | |
| SCHEMBL14313644 | 0.79 | CASP3 (0.50) | CTSBCTSKCTSSCTSLCPB1 | |
| SCHEMBL21111192 | 0.78 | CPB1 (0.49) | CTSBCTSKCTSSCTSLCPB1 | |
| SCHEMBL14018496 | 0.76 | CPB1 (0.57) | CTSBCTSKCTSSCTSLCPB1 | |
| SCHEMBL16786076 | 0.76 | PREP (0.49) | — | |
| SCHEMBL11455046 | 0.76 | CPB1 (0.54) | CTSBCTSKCTSSCTSLCPB1 |
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-111032651-A | Heterocyclic compounds | 武田药品工业株式会社 | 2020-04-17 | — | — | CN | disclosed |