Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 12/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13063997 | 0.75 | ALDH1A1 (0.41) | SMN1; SMN2ALDH1A1AKT1HTTCYP3A4 | |
| SCHEMBL12570475 | 0.71 | PDGFRB (0.43) | CYP1A2SMN1; SMN2HTTNPC1RAB9A | |
| SCHEMBL9494042 | 0.71 | LMNA (0.50) | CYP1A2SMN1; SMN2ALDH1A1HTTNPC1 | |
| SCHEMBL30421381 | 0.69 | CYP1A2 (0.49) | ADORA3CYP1A2SMN1; SMN2ALDH1A1AKT1 | |
| SCHEMBL15881342 | 0.69 | NPC1 (0.62) | CYP1A2SMN1; SMN2ALDH1A1AKT1HTT | |
| SCHEMBL15829874 | 0.69 | FLT3 (0.37) | — | |
| SCHEMBL12593665 | 0.69 | EDNRB (0.45) | CYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL10272488 | 0.69 | LMNA (0.47) | CYP1A2SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL10626855 | 0.68 | CYP1A2 (0.61) | ADORA3CYP1A2SMN1; SMN2ALDH1A1AKT1 | |
| SCHEMBL12570771 | 0.67 | NOS3 (0.34) | CYP1A2SMN1; SMN2ALDH1A1CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010138820-A2 | N,N-DIARYLUREA COMPOUNDS AND N,N'-DIARYLTHIOUREA COMPOUNDS AS INHIBITORS OF TRANSLATION INITIATION | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2010-12-02 | — | — | WO | disclosed |