Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | VNN1 | O95497 | 4/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 6/20 | 0.36 |
| ▸ | FLT1 | P17948 | 3/20 | 0.36 |
| ▸ | NR2E1 | Q9Y466 | 3/20 | 0.36 |
| ▸ | RORA | P35398 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | CLK1 | P49759 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5235758 | 1.00 | AURKA (0.39) | AURKACYP1A2LOXL2VNN1TACR1 | |
| SCHEMBL5240093 | 0.86 | CNR2 (0.45) | CYP1A2LOXL2KDRFLT1CLK1 | |
| SCHEMBL5231738 | 0.86 | CNR2 (0.45) | CYP1A2LOXL2KDRFLT1CLK1 | |
| SCHEMBL5237502 | 0.85 | LOXL2 (0.43) | AURKACYP1A2LOXL2TACR1KDR | |
| SCHEMBL5235015 | 0.85 | LOXL2 (0.43) | AURKACYP1A2LOXL2TACR1KDR | |
| SCHEMBL5235487 | 0.83 | CYP1A2 (0.44) | AURKACYP1A2LOXL2VNN1TACR1 | |
| SCHEMBL5237802 | 0.82 | CYP1A2 (0.44) | AURKACYP1A2LOXL2KDR | |
| SCHEMBL5234948 | 0.81 | LOXL2 (0.46) | CYP1A2LOXL2 | |
| SCHEMBL5234952 | 0.81 | LOXL2 (0.46) | CYP1A2LOXL2 | |
| SCHEMBL5238056 | 0.78 | CYP1A2 (0.54) | CYP1A2LOXL2 |
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-1397364-B1 | NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | LILLY CO ELI (US) | 2007-07-25 | — | — | EP | disclosed |