Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | PIN1 | Q13526 | 9/20 | 0.53 |
| ▸ | CTSL | P07711 | 1/20 | 0.52 |
| ▸ | CTSB | P07858 | 1/20 | 0.52 |
| ▸ | CTSS | P25774 | 1/20 | 0.52 |
| ▸ | CTSK | P43235 | 1/20 | 0.52 |
| ▸ | CCKBR | P32239 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | MME | P08473 | 1/20 | 0.50 |
| ▸ | ACE | P12821 | 1/20 | 0.50 |
| ▸ | CPA1 | P15085 | 1/20 | 0.50 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10119206 | 0.87 | CTSL (0.61) | L3MBTL1CTSLCTSBCTSSCTSK | |
| SCHEMBL24784813 | 0.87 | CTSB (0.48) | L3MBTL1PIN1CTSLCTSBCTSS | |
| SCHEMBL16576408 | 0.81 | PIN1 (0.56) | L3MBTL1PIN1CTSLCTSBCTSS | |
| SCHEMBL30291662 | 0.80 | CTSB (0.56) | L3MBTL1CTSLCTSBCTSSHDAC3 | |
| SCHEMBL16576475 | 0.80 | CCR1 (0.58) | PIN1CTSLCTSBCTSSCTSK | |
| SCHEMBL18064466 | 0.80 | CCR1 (0.58) | PIN1CTSLCTSBCTSSCTSK | |
| SCHEMBL18064454 | 0.80 | CCR1 (0.58) | PIN1CTSLCTSBCTSSCTSK | |
| SCHEMBL16576552 | 0.80 | CCR1 (0.58) | PIN1CTSLCTSBCTSSCTSK | |
| SCHEMBL7973132 | 0.79 | TACR1 (0.61) | L3MBTL1PIN1CTSLCTSBCTSS | |
| SCHEMBL7515793 | 0.79 | CA2 (0.63) | PIN1CA2MMEACECPA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022265577-A2 | CORONAVIRUS ENZYME MODULATORS, METHODS OF SYNTHESIS AND USES THEREOF | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2022-12-22 | — | — | WO | disclosed |