Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CTSH | P09668 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | CTSC | P53634 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 3/20 | 0.38 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7887287 | 1.00 | CTSB (0.42) | CTSBCTSHCTSSCTSKCTSC | |
| SCHEMBL7355451 | 0.90 | TSHR (0.39) | CTSBCTSHCTSSCTSKCTSC | |
| SCHEMBL7355457 | 0.90 | TSHR (0.39) | CTSBCTSHCTSSCTSKCTSC | |
| SCHEMBL19015928 | 0.86 | ABCB1 (0.40) | CTSBCTSHCTSSCTSKCTSC | |
| SCHEMBL7885855 | 0.82 | PPARG (0.40) | ABCB1CA2CA9CA12CA1 | |
| SCHEMBL7967484 | 0.82 | ABCB1 (0.39) | ABCB1CA2CA9SLC7A5HSD11B1 | |
| SCHEMBL7358261 | 0.81 | CASP3 (0.52) | CTSBCTSHCTSSCTSKCTSC | |
| SCHEMBL7358274 | 0.81 | CASP3 (0.52) | CTSBCTSHCTSSCTSKCTSC | |
| SCHEMBL7358268 | 0.81 | CASP3 (0.52) | CTSBCTSHCTSSCTSKCTSC | |
| SCHEMBL12755481 | 0.81 | CTSB (0.42) | CTSBCTSHCTSSCTSKCTSC |
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 |
|---|---|---|---|---|---|---|---|
| EP-2288615-B1 | SELECTIVE CASPASE INHIBITORS AND USES THEREOF | GENESIS TECH LTD (BB) | 2017-06-21 | — | — | EP | disclosed |