Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SDCBP | O00560 | 1/20 | 0.39 |
| ▸ | SDC2 | P34741 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11357838 | 0.98 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2EPHX2NPSR1EPHX1 | |
| SCHEMBL6138080 | 0.87 | HPGD (0.46) | ALDH1A1SMN1; SMN2EPHX2NPSR1EPHX1 | |
| SCHEMBL6138081 | 0.87 | HPGD (0.46) | ALDH1A1SMN1; SMN2EPHX2NPSR1EPHX1 | |
| SCHEMBL296883 | 0.84 | L3MBTL1 (0.54) | ALDH1A1EPHX2EPHX1HPGDKMT2A | |
| SCHEMBL6136574 | 0.82 | LTA4H (0.52) | ALDH1A1SMN1; SMN2EPHX2EPHX1HPGD | |
| SCHEMBL4414768 | 0.82 | LTA4H (0.52) | ALDH1A1SMN1; SMN2EPHX2EPHX1HPGD | |
| SCHEMBL7882899 | 0.81 | KMT2A (0.53) | SMN1; SMN2EPHX2EPHX1HPGDKMT2A | |
| SCHEMBL6136293 | 0.81 | LTA4H (0.55) | SMN1; SMN2EPHX2EPHX1HPGDKMT2A | |
| SCHEMBL6136289 | 0.81 | LTA4H (0.55) | SMN1; SMN2EPHX2EPHX1HPGDKMT2A | |
| SCHEMBL7437533 | 0.80 | HPGD (0.57) | SMN1; SMN2EPHX2EPHX1HPGDKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-8791264-B2 | Benzenesulfonamide compounds and their use as blockers of calcium channels | PURDUE PHARMA L.P. (US) | 2014-07-29 | — | — | US | disclosed |