Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.44 |
| ▸ | CASP6 | P55212 | 2/20 | 0.44 |
| ▸ | CASP8 | Q14790 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MME | P08473 | 2/20 | 0.38 |
| ▸ | ACE | P12821 | 2/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.38 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
| ▸ | CAPN1 | P07384 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6629068 | 1.00 | CASP3 (0.44) | CASP3CASP6CASP8RAB9AMEN1 | |
| SCHEMBL6629364 | 0.88 | CASP1 (0.50) | CASP3CASP6CASP8MMEACE | |
| SCHEMBL6631460 | 0.80 | CASP1 (0.48) | CASP3CASP6CASP8RAB9AMEN1 | |
| SCHEMBL6629124 | 0.77 | CASP3 (0.48) | CASP3CASP6CASP8RAB9AMEN1 | |
| SCHEMBL6629120 | 0.77 | CASP3 (0.48) | CASP3CASP6CASP8RAB9AMEN1 | |
| SCHEMBL6627306 | 0.76 | LCK (0.48) | MMEACELCKCASP1 | |
| SCHEMBL6627304 | 0.76 | LCK (0.48) | MMEACELCKCASP1 | |
| SCHEMBL6629773 | 0.75 | CASP1 (0.44) | CASP3CASP6CASP8RAB9AMEN1 | |
| SCHEMBL6676663 | 0.75 | CASP1 (0.43) | CASP3CASP6CASP8RAB9AMEN1 | |
| SCHEMBL6627545 | 0.75 | LCK (0.47) | MMEACELCKCAPN1CASP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1246824-B1 | CARBOXAMIDE DIAZEPIN DERIVATIVES, PREPARATION METHOD, USE AS MEDICINES, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF | AVENTIS PHARMA SA (FR) | 2004-06-09 | — | — | EP | claimed |