Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 2/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 10/20 | 0.35 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5238769 | 0.86 | CYP1A2 (0.40) | KDRCYP1A2 | |
| SCHEMBL5238764 | 0.86 | CYP1A2 (0.40) | KDRCYP1A2 | |
| SCHEMBL5238619 | 0.83 | KDR (0.35) | KDRCYP1A2AURKA | |
| SCHEMBL5233924 | 0.81 | KDR (0.38) | KDRCYP1A2DGAT2 | |
| SCHEMBL5233927 | 0.81 | KDR (0.38) | KDRCYP1A2DGAT2 | |
| SCHEMBL5235220 | 0.81 | KDR (0.44) | KDRCYP1A2DGAT2POLB | |
| SCHEMBL5235216 | 0.81 | KDR (0.44) | KDRCYP1A2DGAT2POLB | |
| SCHEMBL5235150 | 0.80 | CYP1A2 (0.40) | CYP1A2 | |
| SCHEMBL5235146 | 0.80 | CYP1A2 (0.40) | CYP1A2 | |
| SCHEMBL5239587 | 0.79 | AR (0.39) | KDRCYP1A2P2RX7 |
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 |