Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | VNN1 | O95497 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7378072 | 0.77 | AR (0.42) | MAPTALDH1A1CYP1A2TSHRVNN1 | |
| SCHEMBL7381052 | 0.76 | VNN1 (0.46) | ALDH1A1TDP1TSHRHTTVNN1 | |
| SCHEMBL7382585 | 0.74 | MEN1 (0.47) | ALDH1A1CYP1A2CYP2D6TDP1POLB | |
| SCHEMBL7380717 | 0.72 | CHRNA7 (0.42) | ALDH1A1CYP1A2CYP2D6TDP1L3MBTL1 | |
| SCHEMBL8726941 | 0.69 | LTA4H (0.52) | CYP1A2CYP2D6 | |
| SCHEMBL7384351 | 0.69 | CYP1A2 (0.43) | CYP1A2CYP2D6TDP1L3MBTL1HTT | |
| SCHEMBL7381665 | 0.69 | MAPT (0.47) | MAPTALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL7379652 | 0.69 | ALDH1A1 (0.33) | MAPTALDH1A1KDM4E | |
| SCHEMBL272335 | 0.69 | — | — | |
| SCHEMBL7384248 | 0.69 | HTR1A (0.45) | ALDH1A1CYP1A2TSHRKDM4E |
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 |