Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.39 |
| ▸ | CTSL | P07711 | 4/20 | 0.38 |
| ▸ | CTSK | P43235 | 4/20 | 0.38 |
| ▸ | CTSS | P25774 | 3/20 | 0.38 |
| ▸ | CTSB | P07858 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7293627 | 0.82 | ALDH1A1 (0.58) | CTSLCTSKCTSSCTSBALDH1A1 | |
| SCHEMBL7285600 | 0.79 | CTSL (0.46) | PSMB5CTSLCTSKCTSSCTSB | |
| SCHEMBL7277116 | 0.77 | CTSS (0.45) | PSMB5CTSLCTSKCTSSCTSB | |
| SCHEMBL9725809 | 0.71 | ALDH1A1 (0.48) | CTSLCTSKCTSSCTSBALDH1A1 | |
| SCHEMBL7292590 | 0.71 | TACR1 (0.46) | PSMB5CTSLCTSKCTSSCTSB | |
| SCHEMBL7293543 | 0.70 | ALDH1A1 (0.61) | CTSLCTSKCTSSCTSBALDH1A1 | |
| SCHEMBL7285846 | 0.69 | CTSL (0.44) | PSMB5CTSLCTSKCTSSCTSB | |
| SCHEMBL7293240 | 0.67 | CTSB (0.45) | PSMB5CTSLCTSKCTSSCTSB | |
| Bicarbonate SCHEMBL28233769 | 0.67 | NPC1 (0.49) | KDM4EALDH1A1 | |
| SCHEMBL17967529 | 0.67 | TSHR (0.48) | MMP9MME |
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-0376012-A2 | Renin inhibitors | AMERICAN CYANAMID COMPANY (US) | 1990-07-04 | — | — | EP | disclosed |