Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24970601 | 0.85 | CTSK (0.44) | CTSKSSTR4CA1CA2DRD2 | |
| SCHEMBL3238345 | 0.85 | TSHR (0.41) | CTSKCA1CA2ALDH1A1KMT2A | |
| SCHEMBL18247774 | 0.85 | TSHR (0.41) | CTSKCA1CA2ALDH1A1KMT2A | |
| SCHEMBL24850160 | 0.79 | CTSK (0.46) | CTSKCA1CA2DRD2CYP2C9 | |
| SCHEMBL18909589 | 0.79 | CTSK (0.46) | CTSKCA1CA2DRD2CYP2C9 | |
| SCHEMBL22590344 | 0.79 | CTSK (0.46) | CTSKCA1CA2DRD2CYP2C9 | |
| SCHEMBL89226 | 0.79 | BTK (0.46) | CTSKCA1CA2ALDH1A1KMT2A | |
| SCHEMBL13125589 | 0.79 | EPHX1 (0.43) | CTSKCA1CA2ALDH1A1KMT2A | |
| SCHEMBL13168561 | 0.78 | MAOB (0.43) | CTSKALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL18909588 | 0.78 | CTSK (0.45) | CTSKSSTR4CA1CA2DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3298003-B1 | BENZOIMIDAZOLE DERIVATIVES AS PAD4 INHIBITORS | GLAXOSMITHKLINE IP DEV LTD (GB) | 2023-04-19 | — | — | EP | disclosed |