Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 8/20 | 0.55 |
| ▸ | ALOX5 | P09917 | 7/20 | 0.55 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.47 |
| ▸ | NTRK1 | P04629 | 7/20 | 0.47 |
| ▸ | NTRK2 | Q16620 | 7/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20103613 | 0.93 | ALOX5 (0.47) | EPHX2ALOX5ALOX5APNTRK1NTRK2 | |
| SCHEMBL20103607 | 0.84 | ALOX5 (0.51) | EPHX2ALOX5ALOX5APNTRK1NTRK2 | |
| SCHEMBL20103615 | 0.76 | NPC1 (0.56) | EPHX2ALOX5NTRK1NTRK2MEN1 | |
| SCHEMBL368032 | 0.72 | CYP1A2 (0.45) | MEN1KMT2AALDH1A1 | |
| SCHEMBL14838247 | 0.72 | CYP1A2 (0.47) | MEN1KMT2AALDH1A1 | |
| SCHEMBL20103496 | 0.71 | ALOX5 (0.63) | EPHX2ALOX5NTRK1NTRK2MEN1 | |
| SCHEMBL20103600 | 0.71 | EPHX2 (0.63) | EPHX2ALOX5ALOX5APMEN1KMT2A | |
| SCHEMBL14300652 | 0.71 | CYP1A2 (0.46) | MEN1KMT2AALDH1A1 | |
| SCHEMBL4698252 | 0.71 | SMN1; SMN2 (0.47) | KMT2AALDH1A1PKM | |
| SCHEMBL6095249 | 0.71 | MAPT (0.47) | ALDH1A1HTT |
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 |