Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CTSB | P07858 | 3/20 | 0.44 |
| ▸ | CTSS | P25774 | 3/20 | 0.44 |
| ▸ | CTSL | P07711 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 3/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1162745 | 0.89 | ALDH1A1 (0.48) | ALDH1A1CTSBCTSSCTSLGAA | |
| SCHEMBL19920769 | 0.79 | CTSL (0.46) | ALDH1A1CTSBCTSSCTSLGAA | |
| SCHEMBL19900624 | 0.79 | CTSS (0.50) | ALDH1A1CTSBCTSSCTSLGAA | |
| SCHEMBL19900776 | 0.78 | CTSB (0.50) | ALDH1A1CTSBCTSSCTSLGAA | |
| SCHEMBL19920812 | 0.77 | LMNA (0.44) | ALDH1A1CTSBCTSSCTSLGAA | |
| SCHEMBL19920827 | 0.77 | CTSB (0.49) | ALDH1A1CTSBCTSSCTSLGAA | |
| SCHEMBL29857191 | 0.76 | CTSS (0.48) | ALDH1A1CTSBCTSSCTSLGAA | |
| SCHEMBL19920814 | 0.76 | LMNA (0.43) | ALDH1A1CTSBCTSSCTSLGAA | |
| SCHEMBL19920764 | 0.76 | CTSB (0.48) | ALDH1A1CTSBCTSSCTSLNPC1 | |
| SCHEMBL23671289 | 0.74 | LMNA (0.47) | ALDH1A1CTSBCTSSCTSLGAA |
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-109790168-A | SUBSTITUTED PYRROLIZINE COMPOUNDS AND USES THEREOF | 吉利德科学公司 | 2019-05-21 | — | — | CN | disclosed |