Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 6/20 | 0.55 |
| ▸ | MMP9 | P14780 | 5/20 | 0.55 |
| ▸ | MMP8 | P22894 | 1/20 | 0.55 |
| ▸ | MMP12 | P39900 | 1/20 | 0.55 |
| ▸ | MMP14 | P50281 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7793406 | 0.86 | POLB (0.49) | MMP2MMP8CYP2C9CYP2C19CA2 | |
| SCHEMBL7803203 | 0.85 | POLB (0.51) | MMP8CYP2C9CYP2C19CA2CA1 | |
| SCHEMBL7793404 | 0.85 | F10 (0.48) | MMP2MMP9MMP8HTTCYP2C9 | |
| SCHEMBL7798914 | 0.77 | POLB (0.48) | MMP2MMP9ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL7793435 | 0.77 | CA12 (0.52) | MMP8ALDH1A1CYP2C9CYP2C19CA2 | |
| SCHEMBL7793390 | 0.76 | KMT2A (0.57) | ALDH1A1CA2CA12CA9 | |
| SCHEMBL7799262 | 0.75 | POLB (0.52) | MMP8CYP2C9CYP2C19ITGB3ITGA2B | |
| SCHEMBL6021548 | 0.74 | CTSL (0.45) | MMP2MMP9MMP8MMP12MMP14 | |
| SCHEMBL29376103 | 0.74 | BDKRB1 (0.52) | MMP2MMP9MMP8MMP12MMP14 | |
| SCHEMBL8707457 | 0.74 | ALDH1A1 (0.63) | MMP2MMP9MMP8MMP12MMP14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1143960-A2 | CYSTINE DERIVATIVES AS THERAPEUTIC AGENTS FOR MATRIX METALLOPROTEASE RELATED DISEASES | Roche Diagnostics GmbH (DE) | 2001-10-17 | — | — | EP | disclosed |
| WO-2000027378-A2 | CYSTINE DERIVATIVES AS THERAPEUTIC AGENTS FOR MATRIX METALLOPROTEASE RELATED DISEASES | ROCHE DIAGNOSTICS GMBH (DE) | 2000-05-18 | — | — | WO | disclosed |