Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 7/20 | 0.50 |
| ▸ | CTSS | P25774 | 5/20 | 0.49 |
| ▸ | CTSL | P07711 | 4/20 | 0.49 |
| ▸ | CTSB | P07858 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.48 |
| ▸ | KYNU | Q16719 | 1/20 | 0.47 |
| ▸ | TACR1 | P25103 | 2/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4971022 | 0.88 | KYNU (0.57) | CTSKCTSSCTSLCTSBALDH1A1 | |
| SCHEMBL29001931 | 0.87 | CTSS (0.46) | CTSKCTSSCTSLCTSBALDH1A1 | |
| SCHEMBL30452075 | 0.87 | CTSS (0.46) | CTSKCTSSCTSLCTSBALDH1A1 | |
| SCHEMBL4972907 | 0.87 | CTSK (0.52) | CTSKCTSSCTSLCTSBALDH1A1 | |
| SCHEMBL4972916 | 0.87 | CTSK (0.52) | CTSKCTSSCTSLCTSBALDH1A1 | |
| SCHEMBL2550717 | 0.83 | CA2 (0.52) | CTSKCTSSCTSLCTSBCA5A | |
| SCHEMBL7917484 | 0.83 | CA2 (0.52) | CTSKCTSSCTSLCTSBCA5A | |
| SCHEMBL2550712 | 0.83 | CA2 (0.52) | CTSKCTSSCTSLCTSBCA5A | |
| SCHEMBL24263446 | 0.83 | CTSK (0.56) | CTSKCTSSCTSLCTSBALDH1A1 | |
| SCHEMBL14842340 | 0.80 | CTRB1 (0.52) | CTSKALDH1A1ALOX15KYNUATM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115916207-A | Five-membered and six-membered heterocyclic compounds and application thereof as protein receptor kinase inhibitors | 轶诺(浙江)药业有限公司 | 2023-04-04 | — | — | CN | disclosed |
| WO-2022037694-A1 | A CLASS OF FIVE- AND SIX-MEMBERED HETEROCYCLIC COMPOUNDS AND USE THEREOF AS PROTEIN RECEPTOR KINASE INHIBITORS | 轶诺(浙江)药业有限公司 | 2022-02-24 | — | — | WO | disclosed |