Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 5/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | FLT1 | P17948 | 2/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL6172522 | 0.88 | CYP3A4 (0.40) | ALDH1A1NPC1RAB9AL3MBTL1CYP3A4 | |
| SCHEMBL6173899 | 0.87 | ALDH1A1 (0.39) | ALDH1A1NPC1RAB9AL3MBTL1CYP3A4 | |
| SCHEMBL6172103 | 0.86 | RXFP1 (0.42) | ALDH1A1L3MBTL1CYP3A4GAACYP2C9 | |
| SCHEMBL6175486 | 0.85 | CYP3A4 (0.40) | ALDH1A1NPC1RAB9AL3MBTL1KDR | |
| SCHEMBL6174515 | 0.85 | ALDH1A1 (0.45) | ALDH1A1CYP3A4GAACYP2C9CYP2C19 | |
| SCHEMBL6172844 | 0.85 | CYP3A4 (0.40) | ALDH1A1NPC1RAB9AL3MBTL1KDR | |
| SCHEMBL6174469 | 0.84 | TDP1 (0.42) | ALDH1A1NR3C1KDRCYP3A4GAA | |
| SCHEMBL6174774 | 0.83 | SLC5A1 (0.40) | ALDH1A1L3MBTL1CYP3A4GAACYP2C9 | |
| SCHEMBL6175907 | 0.83 | ALDH1A1 (0.39) | ALDH1A1NPC1RAB9AKDRCYP3A4 | |
| SCHEMBL6173479 | 0.82 | ALDH1A1 (0.44) | ALDH1A1CYP3A4GAACYP2C9CYP2C19 |
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 |