Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | ADAMTS5 | Q9UNA0 | 5/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.37 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL6175575 | 0.91 | EPHX2 (0.40) | KCNA5TP53MDM2ALDH1A1GAA | |
| SCHEMBL6251393 | 0.90 | EPHX2 (0.39) | ALDH1A1GAACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6173046 | 0.90 | CYP3A4 (0.37) | TP53MDM2ALDH1A1GAACYP3A4 | |
| SCHEMBL6172896 | 0.87 | IGF1R (0.39) | TP53MDM2ADAMTS5MMP2MMP13 | |
| SCHEMBL6170496 | 0.85 | CYP3A4 (0.40) | ALDH1A1GAACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6173349 | 0.85 | ALDH1A1 (0.39) | ALDH1A1GAACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2987100 | 0.83 | KCNA5 (0.41) | KCNA5TP53MDM2MGLLCHRM4 | |
| SCHEMBL6176355 | 0.83 | CYP3A4 (0.40) | ALDH1A1GAACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6173171 | 0.83 | KDR (0.42) | ALDH1A1GAACYP3A4MAPTCYP2C9 | |
| SCHEMBL6175742 | 0.82 | ALDH1A1 (0.37) | CHRM4GPBAR1ALDH1A1GAACYP3A4 |
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 |