Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | G6PD | P11413 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19339696 | 0.88 | ALDH1A1 (0.45) | KDM4EALDH1A1ALOX15CYP3A4THRB | |
| SCHEMBL15317985 | 0.77 | KDM4E (0.44) | KDM4ECYP17A1ALDH1A1ALOX15CYP3A4 | |
| SCHEMBL19339699 | 0.76 | CYP1A2 (0.49) | KDM4EALDH1A1CYP3A4TDP1MEN1 | |
| SCHEMBL9717234 | 0.75 | KDM4E (0.43) | KDM4ECYP17A1ALDH1A1ALOX15CYP3A4 | |
| SCHEMBL4639004 | 0.75 | HPGD (0.58) | KDM4EALDH1A1ALOX15CYP3A4THRB | |
| SCHEMBL20872048 | 0.75 | PLA2G7 (0.50) | KDM4EALDH1A1ALOX15CYP3A4THRB | |
| SCHEMBL29416259 | 0.75 | HPGD (0.58) | KDM4EALDH1A1ALOX15CYP3A4THRB | |
| SCHEMBL13308526 | 0.75 | HPGD (0.58) | KDM4EALDH1A1ALOX15CYP3A4THRB | |
| SCHEMBL10755679 | 0.72 | NPSR1 (0.64) | ALDH1A1CYP3A4MEN1GAAKMT2A | |
| SCHEMBL23567608 | 0.70 | HPGD (0.52) | KDM4EALDH1A1ALOX15CYP3A4THRB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3309157-B1 | ANTIVIRAL COMPOUNDS | GILEAD PHARMASSET LLC (US) | 2019-09-04 | — | — | EP | disclosed |
| EP-3309157-A1 | ANTIVIRAL COMPOUNDS | Gilead Pharmasset LLC (US) | 2018-04-18 | — | — | EP | disclosed |
| EP-3002281-B1 | ANTIVIRAL COMPOUNDS | GILEAD PHARMASSET LLC (US) | 2017-09-13 | — | — | EP | disclosed |