Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.48 |
| ▸ | NPC1 | O15118 | 7/20 | 0.48 |
| ▸ | RAB9A | P51151 | 7/20 | 0.48 |
| ▸ | LMNA | P02545 | 5/20 | 0.48 |
| ▸ | TP53 | P04637 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.46 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL20103473 | 0.89 | ALOX5 (0.67) | ALOX5ALOX5APEPHX2SMN1; SMN2NPC1 | |
| SCHEMBL20103463 | 0.89 | RAB9A (0.59) | ALOX5EPHX2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL20103496 | 0.79 | ALOX5 (0.63) | ALOX5EPHX2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL20103550 | 0.77 | NPC1 (0.64) | SMN1; SMN2NPC1RAB9ALMNATP53 | |
| SCHEMBL20103607 | 0.75 | ALOX5 (0.51) | ALOX5ALOX5APEPHX2SMN1; SMN2RAB9A | |
| SCHEMBL6524094 | 0.72 | MAPT (0.53) | LMNATP53HTTKMT2AMEN1 | |
| SCHEMBL9632868 | 0.70 | SMN1; SMN2 (0.49) | ALOX5ALOX5APEPHX2SMN1; SMN2NPC1 | |
| SCHEMBL14642400 | 0.70 | TP53 (0.62) | LMNATP53HTTKMT2AGAA | |
| SCHEMBL20103602 | 0.70 | EPHX2 (1.00) | ALOX5ALOX5APEPHX2 | |
| SCHEMBL20103574 | 0.70 | ALOX5 (0.67) | ALOX5ALOX5APEPHX2SMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018077898-A1 | N,N'-DIARYLUREA, N,N'-DIARYLTHIOUREA AND N,N'-DIARYLGUANIDINO COMPOUNDS FOR USE IN TREATMENT AND PREVENTION OF INFLAMMATORY DISEASE | UNIVERSITÄT INNSBRUCK (AT) | 2018-05-03 | — | — | WO | disclosed |
| EP-3315495-A1 | N,N' -DIARYLUREA, N,N' -DIARYLTHIOUREA AND N,N' -DIARYLGUANIDINO COMPOUNDS FOR USE IN TREATMENT AND PREVENTION OF INFLAMMATORY DISEASE | Universität Innsbruck (AT) | 2018-05-02 | — | — | EP | disclosed |