Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 5/20 | 0.41 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.41 |
| ▸ | GAK | O14976 | 1/20 | 0.41 |
| ▸ | ADK | P55263 | 1/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5237830 | 0.86 | EGLN1 (0.49) | EGLN1HDAC3HDAC2KCNH2NPC1 | |
| SCHEMBL4676744 | 0.84 | KCNH2 (0.59) | EGLN1HDAC3HDAC2KCNH2MEN1 | |
| SCHEMBL928752 | 0.74 | HCRTR1 (0.47) | EGLN1HDAC3HDAC2 | |
| Hydrochloric Acid SCHEMBL1793264 | 0.73 | HCRTR1 (0.47) | EGLN1HDAC3HDAC2 | |
| SCHEMBL13917342 | 0.69 | CYP2C9 (0.53) | EGLN1KCNH2NPC1RAB9AMEN1 | |
| SCHEMBL4677360 | 0.68 | GRIN2D (0.53) | MEN1KMT2ACNR2CYP2C9 | |
| SCHEMBL1447393 | 0.68 | CNR2 (0.55) | KMT2ACNR2 | |
| SCHEMBL2827765 | 0.68 | FYN (0.56) | EGLN1KCNH2NPC1RAB9AMEN1 | |
| SCHEMBL10408880 | 0.68 | KDM4E (0.52) | KCNH2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL1035325 | 0.68 | MAPT (0.34) | NPC1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0958287-B2 | SULFAMIDE-METALLOPROTEASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2008-04-09 | — | — | EP | disclosed |
| EP-0958287-B1 | SULFAMIDE-METALLOPROTEASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2002-09-11 | — | — | EP | disclosed |