Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 6/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.50 |
| ▸ | USP25 | Q9UHP3 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | PTGER1 | P34995 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16043356 | 1.00 | CCR5 (0.51) | CCR5SLC6A4ALDH1A1MAOBUSP28 | |
| SCHEMBL27134824 | 0.87 | CCR5 (0.62) | CCR5SLC6A4ALDH1A1MAOBUSP28 | |
| SCHEMBL11839270 | 0.85 | CCR5 (0.56) | CCR5SLC6A4ALDH1A1MAOBUSP28 | |
| SCHEMBL30758619 | 0.85 | CCR5 (0.56) | CCR5SLC6A4ALDH1A1MAOBUSP28 | |
| SCHEMBL16293828 | 0.84 | CCR5 (0.51) | CCR5SLC6A4ALDH1A1MAOBUSP28 | |
| SCHEMBL16064489 | 0.84 | USP28 (0.57) | CCR5SLC6A4ALDH1A1MAOBUSP28 | |
| SCHEMBL9774223 | 0.82 | ALOX5 (0.54) | MAOBRAB9ASMN1; SMN2LMNACYP1A2 | |
| SCHEMBL368071 | 0.81 | SLC6A4 (0.66) | CCR5SLC6A4ALDH1A1MAOBUSP28 | |
| SCHEMBL31644088 | 0.81 | SLC6A4 (0.66) | CCR5SLC6A4ALDH1A1MAOBUSP28 | |
| SCHEMBL2394736 | 0.81 | L3MBTL1 (0.48) | ALDH1A1PTGER1LMNA |
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-108707140-B | Protease C inhibitors | 勃林格殷格翰国际有限公司 | 2022-07-22 | — | — | CN | disclosed |