Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 3/20 | 0.31 |
| ▸ | ITGAV | P06756 | 1/20 | 0.31 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.31 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 4/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4154124 | 0.94 | CNR1 (0.35) | CNR1ITGAVITGA5ITGB6EGFR | |
| SCHEMBL8317288 | 0.91 | CNR1 (0.36) | CNR1ITGAVITGA5ITGB6EGFR | |
| SCHEMBL3003700 | 0.89 | EGFR (0.35) | EGFRERBB2ALDH1A1LMNAHRH4 | |
| SCHEMBL4162062 | 0.89 | AURKA (0.33) | CNR1ITGAVITGA5ITGB6EGFR | |
| SCHEMBL4158304 | 0.88 | EPHA2 (0.33) | CNR1ITGAVITGA5ITGB6EGFR | |
| SCHEMBL13772294 | 0.88 | RPS6KB1 (0.33) | CNR1ALDH1A1LMNAHRH4CNR2 | |
| SCHEMBL3000212 | 0.88 | RPS6KB1 (0.33) | CNR1ALDH1A1LMNAHRH4CNR2 | |
| SCHEMBL8320265 | 0.88 | RPS6KB1 (0.33) | CNR1ALDH1A1LMNAHRH4CNR2 | |
| SCHEMBL2992118 | 0.87 | ALDH1A1 (0.44) | ALDH1A1LMNA | |
| SCHEMBL2995895 | 0.87 | ITGAV (0.37) | ITGAVITGA5ITGB6EGFRERBB2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004058743-A1 | NOVEL SUBSTITUTED NITROGEN-CONTAINING HETEROBICYCLES AND USE THEREOF AS FACTOR XA INHIBITORS | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2004-07-15 | — | — | WO | disclosed |