Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 5/20 | 0.45 |
| ▸ | CTSS | P25774 | 4/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8971806 | 0.85 | ACACB (0.46) | — | |
| SCHEMBL28515363 | 0.85 | CYP2D6 (0.40) | ATMCYP2D6KLK5 | |
| SCHEMBL28519422 | 0.83 | CYP2D6 (0.43) | CTSKCTSSATMCTSLCTSB | |
| SCHEMBL27513442 | 0.83 | NFKB1 (0.55) | CTSKCTSSMMP13CTSLCTSB | |
| SCHEMBL12712218 | 0.82 | ACACB (0.38) | CTSKCTSSCTSLCTSBCYP2D6 | |
| SCHEMBL10721035 | 0.81 | REN (0.56) | — | |
| SCHEMBL10721023 | 0.81 | REN (0.56) | — | |
| SCHEMBL8972541 | 0.81 | KLK5 (0.55) | CTSKCTSSATMCTSLCTSB | |
| SCHEMBL75663 | 0.81 | KLK5 (0.55) | CTSKCTSSATMCTSLCTSB | |
| SCHEMBL8972067 | 0.81 | MTNR1A (0.62) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5518903-A | HYDROLYSIS OF ESTER | CHISSO CORPORATION (JP) | 1996-05-21 | — | — | US | disclosed |