Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 7/20 | 0.52 |
| ▸ | CTSS | P25774 | 6/20 | 0.50 |
| ▸ | CTSK | P43235 | 6/20 | 0.50 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18170221 | 1.00 | AAK1 (0.52) | AAK1CTSSCTSKCTSBALDH1A1 | |
| SCHEMBL19858730 | 0.94 | AAK1 (0.51) | AAK1CTSSCTSKCTSBALDH1A1 | |
| SCHEMBL17483620 | 0.94 | AAK1 (0.51) | AAK1CTSSCTSKCTSBALDH1A1 | |
| SCHEMBL27124976 | 0.92 | ALDH1A1 (0.54) | AAK1CTSSCTSKCTSBALDH1A1 | |
| SCHEMBL16447830 | 0.91 | CTSS (0.53) | AAK1CTSSCTSKCTSBPTPN1 | |
| SCHEMBL16064072 | 0.91 | CTSS (0.53) | AAK1CTSSCTSKCTSBPTPN1 | |
| SCHEMBL16035979 | 0.89 | AAK1 (0.51) | AAK1CTSSCTSKCTSBALDH1A1 | |
| SCHEMBL30476240 | 0.89 | AAK1 (0.51) | AAK1CTSSCTSKCTSBALDH1A1 | |
| SCHEMBL19858738 | 0.89 | AAK1 (0.51) | AAK1CTSSCTSKCTSBALDH1A1 | |
| SCHEMBL21722664 | 0.88 | CTSS (0.52) | AAK1CTSSCTSKCTSBALDH1A1 |
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-110642878-A | Preparation method of fluorine-labeled BPA | 中国医学科学院北京协和医院 | 2020-01-03 | — | — | CN | disclosed |
| CN-110642879-A | Preparation method of fluorine-labeled BPA | 中国医学科学院北京协和医院 | 2020-01-03 | — | — | CN | disclosed |