Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | GLS | O94925 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | FERMT2 | Q96AC1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29959944 | 0.90 | CYP1A2 (0.47) | CYP1A2LOXL2PDE4AMEN1KMT2A | |
| SCHEMBL5234356 | 0.90 | CYP1A2 (0.47) | CYP1A2LOXL2PDE4AMEN1KMT2A | |
| SCHEMBL5235225 | 0.82 | CYP1A2 (0.49) | CYP1A2LOXL2PDE4AALDH1A1SMN1; SMN2 | |
| SCHEMBL29959459 | 0.82 | CYP1A2 (0.49) | CYP1A2LOXL2PDE4AALDH1A1SMN1; SMN2 | |
| SCHEMBL5233274 | 0.82 | CYP1A2 (0.55) | CYP1A2KDM4ELOXL2PDE4AALDH1A1 | |
| SCHEMBL5236988 | 0.80 | CYP1A2 (0.49) | CYP1A2KDM4ELOXL2PDE4AALDH1A1 | |
| SCHEMBL5236887 | 0.80 | CYP1A2 (0.49) | CYP1A2KDM4ELOXL2PDE4AALDH1A1 | |
| SCHEMBL4872415 | 0.80 | CYP1A2 (0.49) | CYP1A2KDM4ELOXL2PDE4AALDH1A1 | |
| SCHEMBL5235242 | 0.79 | CYP1A2 (0.46) | CYP1A2LOXL2PDE4AMEN1KMT2A | |
| SCHEMBL4872056 | 0.77 | CYP1A2 (0.55) | CYP1A2KDM4ELOXL2KMT2AALDH1A1 |
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 |