Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 7/20 | 0.47 |
| ▸ | CTSS | P25774 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30452308 | 1.00 | CTSK (0.47) | CTSKCTSSKMT2AAAK1CA1 | |
| SCHEMBL29068166 | 1.00 | CTSK (0.47) | CTSKCTSSKMT2AAAK1CA1 | |
| SCHEMBL27893378 | 0.94 | CTSK (0.50) | CTSKCTSSKMT2AAAK1CA1 | |
| SCHEMBL13502923 | 0.94 | CTSK (0.50) | CTSKCTSSKMT2AAAK1CA1 | |
| SCHEMBL25658173 | 0.87 | CA1 (0.42) | CTSKCTSSKMT2ACA1CA2 | |
| SCHEMBL13503038 | 0.85 | CTSK (0.38) | CTSKCTSSKMT2AAAK1CA1 | |
| SCHEMBL13503034 | 0.85 | CTSK (0.38) | CTSKCTSSKMT2AAAK1CA1 | |
| SCHEMBL13502995 | 0.84 | CTSK (0.40) | CTSKCTSSKMT2AAAK1CYP3A4 | |
| SCHEMBL13674044 | 0.83 | CTSK (0.40) | CTSKCTSSCA1CA2CA7 | |
| SCHEMBL24629628 | 0.81 | CTSK (0.36) | CTSKCTSSKMT2ACA1CA2 |
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-116669727-A | Triazole-pyridinyl substituted azacyclohexylacetic acid compounds as LPA receptor antagonists | 唯久生物有限公司 | 2023-08-29 | — | — | CN | disclosed |
| EP-4196220-A1 | TRIAZOLE-PYRIDINYL SUBSTITUTED AZACYCLOHEXYL ACETIC ACID COMPOUNDS AS LPA RECEPTOR ANTAGONISTS | Viva Star Biosciences Limited (HK) | 2023-06-21 | — | — | EP | disclosed |