Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.35 |
| ▸ | PLK4 | O00444 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 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 | |
|---|---|---|---|---|
| SCHEMBL5234867 | 1.00 | CYP1A2 (0.39) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5239257 | 0.89 | CYP1A2 (0.41) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5239266 | 0.89 | CYP1A2 (0.41) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5238643 | 0.85 | CYP1A2 (0.38) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5238650 | 0.85 | CYP1A2 (0.38) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5240236 | 0.84 | CYP1A2 (0.45) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5240230 | 0.84 | CYP1A2 (0.45) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5231418 | 0.84 | CYP1A2 (0.39) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5231407 | 0.84 | CYP1A2 (0.39) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5237953 | 0.82 | CYP1A2 (0.38) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 |
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 |