Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CTSD | P07339 | 4/20 | 0.33 |
| ▸ | BACE1 | P56817 | 4/20 | 0.33 |
| ▸ | BACE2 | Q9Y5Z0 | 4/20 | 0.33 |
| ▸ | MMP2 | P08253 | 3/20 | 0.33 |
| ▸ | MMP1 | P03956 | 2/20 | 0.33 |
| ▸ | MMP3 | P08254 | 2/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.33 |
| ▸ | REN | P00797 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6172098 | 0.92 | AR (0.37) | ARCYP3A4GAACYP2C9CYP2C19 | |
| SCHEMBL6170776 | 0.85 | DGAT2 (0.38) | ARALDH1A1CTSDBACE1BACE2 | |
| SCHEMBL6172334 | 0.85 | IGF1R (0.40) | ARTSHRKMT2AALDH1A1LMNA | |
| SCHEMBL6175571 | 0.84 | ALDH1A1 (0.38) | ARTSHRKMT2ACYP3A4GAA | |
| SCHEMBL6173695 | 0.84 | ITGAL (0.40) | ARKMT2ACYP3A4GAACYP2C9 | |
| SCHEMBL6172435 | 0.83 | POLB (0.38) | ARCYP3A4GAACYP2C9CYP2C19 | |
| SCHEMBL6173183 | 0.82 | CYP3A4 (0.39) | ARCYP3A4GAACYP2C9CYP2C19 | |
| SCHEMBL6277096 | 0.82 | CYP3A4 (0.43) | CYP3A4GAACYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL6170496 | 0.81 | CYP3A4 (0.40) | ARCYP3A4GAACYP2C9CYP2C19 | |
| SCHEMBL6176402 | 0.81 | SLC6A4 (0.36) | ARCYP3A4GAACYP2C9CYP2C19 |
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-1599464-A2 | NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS | Aventis Pharma S.A. (FR) | 2005-11-30 | — | — | EP | disclosed |
| WO-2004070050-A2 | CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS | AVENTIS PHARMA S.A. (FR) | 2004-08-19 | — | — | WO | disclosed |