Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 7/20 | 0.48 |
| ▸ | FDPS | P14324 | 2/20 | 0.47 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.44 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL25318441 | 0.84 | SLC7A5 (0.46) | CYP3A4FDPSNAPRTTBXAS1CYP1A2 | |
| SCHEMBL30476014 | 0.84 | SLC7A5 (0.46) | CYP3A4FDPSNAPRTTBXAS1CYP1A2 | |
| SCHEMBL30759463 | 0.82 | TDP1 (0.47) | CYP3A4FDPSTBXAS1CYP1A2CYP2C9 | |
| SCHEMBL6288293 | 0.82 | ITGA4 (0.51) | CYP1A2MAPT | |
| SCHEMBL8125933 | 0.80 | CYP3A4 (0.52) | CYP3A4MAPT | |
| SCHEMBL29588090 | 0.80 | CYP3A4 (0.52) | CYP3A4MAPT | |
| Hydrochloric Acid SCHEMBL8843832 | 0.79 | FDPS (0.43) | CYP3A4FDPSNAPRTTBXAS1CYP1A2 | |
| SCHEMBL1980092 | 0.78 | SLC7A5 (0.43) | CYP3A4FDPSNAPRTTBXAS1CYP1A2 | |
| SCHEMBL30336917 | 0.77 | CYP3A4 (0.53) | CYP3A4 | |
| SCHEMBL20162475 | 0.77 | LTA4H (0.44) | CYP3A4TBXAS1CYP1A2CYP2C9KDM4E |
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-1165500-A1 | AMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES,TNF-ALPHA,AND AGGRECANASE | Du Pont Pharmaceuticals Company (US) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000059874-A1 | NOVEL AMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES, TNF-α, AND AGGRECANASE | DU PONT PHARMACEUTICALS COMPANY (US) | 2000-10-12 | — | — | WO | disclosed |