Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 4/20 | 0.72 |
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | FAAH | O00519 | 2/20 | 0.62 |
| ▸ | CNR1 | P21554 | 1/20 | 0.59 |
| ▸ | CNR2 | P34972 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | NAAA | Q02083 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11035774 | 0.86 | EPHX2 (0.69) | EPHX2HPGDNAAAEPHX1ALDH1A1 | |
| SCHEMBL11260446 | 0.86 | EPHX2 (0.69) | EPHX2HPGDNAAAEPHX1ALDH1A1 | |
| SCHEMBL3420583 | 0.86 | EPHX2 (0.69) | EPHX2HPGDNAAAEPHX1ALDH1A1 | |
| SCHEMBL3403502 | 0.86 | EPHX2 (0.69) | EPHX2HPGDNAAAEPHX1ALDH1A1 | |
| SCHEMBL19851486 | 0.85 | HPGD (0.62) | EPHX2HPGDFAAHCNR1CNR2 | |
| SCHEMBL19851687 | 0.85 | HPGD (0.62) | EPHX2HPGDFAAHCNR1CNR2 | |
| N-Benzyldodecanamide SCHEMBL3977374 | 0.84 | EPHX2 (1.00) | EPHX2HPGDFAAHCNR1CNR2 | |
| SCHEMBL4985255 | 0.84 | EPHX2 (0.71) | EPHX2HPGDNAAAEPHX1ALDH1A1 | |
| SCHEMBL4585546 | 0.84 | TRPV1 (0.73) | HPGDCNR2MEN1KMT2ANAAA | |
| SCHEMBL4585892 | 0.84 | TRPV1 (0.73) | HPGDCNR2MEN1KMT2ANAAA |
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-0410726-B1 | S-SUBSTITUTED BETA-THIOACRYLAMIDES AND THEIR USE AS MICROBICIDES | ROHM AND HAAS COMPANY (US) | 1993-09-01 | — | — | EP | disclosed |
| US-5118681-A | Bactericides | ROHM AND HAAS COMPANY (US) | 1992-06-02 | — | — | US | disclosed |
| EP-0410726-A1 | S-substituted beta-thioacrylamides and their use as microbicides | ROHM AND HAAS COMPANY (US) | 1991-01-30 | — | — | EP | disclosed |