Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.59 |
| ▸ | NAMPT | P43490 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NT5E | P21589 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 6/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL810378 | 0.87 | IKBKB (0.56) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL810238 | 0.85 | IKBKB (0.54) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL810930 | 0.85 | IKBKB (0.54) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL811142 | 0.85 | IKBKB (0.54) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| Chs-828 SCHEMBL12083293 | 0.85 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8917545 | 0.85 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| Chs-828 SCHEMBL810990 | 0.85 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8918236 | 0.85 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| Chs-828 SCHEMBL16312347 | 0.85 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| Chs-828 SCHEMBL7148798 | 0.84 | IKBKB (0.79) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 |
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-0984938-B1 | CYANOGUANIDINES AS CELL PROLIFERATION INHIBITORS | LEO PHARMA AS WITH SECONDARY N (DK) | 2003-09-10 | — | — | EP | claimed |
| EP-0984938-B1 | CYANOGUANIDINES AS CELL PROLIFERATION INHIBITORS | LEO PHARMA AS WITH SECONDARY N (DK) | 2003-09-10 | — | — | EP | disclosed |