Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 5/20 | 0.47 |
| ▸ | CTSS | P25774 | 2/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ELANE | P08246 | 1/20 | 0.44 |
| ▸ | ANPEP | P15144 | 4/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MMP14 | P50281 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27842755 | 0.82 | ATM (0.45) | ATML3MBTL1ELANEMMP13 | |
| SCHEMBL27842757 | 0.82 | ATM (0.45) | ATML3MBTL1ELANEMMP13 | |
| SCHEMBL29159299 | 0.82 | CTSK (0.43) | CTSKCTSSCTSLCTSBATM | |
| SCHEMBL29159315 | 0.82 | CTSK (0.43) | CTSKCTSSCTSLCTSBATM | |
| SCHEMBL27316483 | 0.81 | CTSK (0.48) | CTSKCTSSCTSLCTSBANPEP | |
| SCHEMBL10594093 | 0.81 | TAS1R3 (0.45) | CTSKCTSSCTSLCTSB | |
| SCHEMBL27479297 | 0.81 | ATM (0.48) | ATML3MBTL1MMP8 | |
| SCHEMBL27688928 | 0.80 | PSMB5 (0.51) | CTSKCTSL | |
| SCHEMBL28285390 | 0.80 | NOS3 (0.47) | CTSKCTSSCTSLCTSB | |
| SCHEMBL2296618 | 0.80 | ELANE (0.49) | ATML3MBTL1ELANEANPEP |
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-1062536-A | Retroviral protease inhibitors from 3-chloro-2-chloromethyl-1-propylene derived | AMERICAN CYANAMID CO (US) | 1992-07-08 | — | — | CN | disclosed |