Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 19/20 | 0.65 |
| ▸ | ESR2 | Q92731 | 18/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL8810633 | 0.99 | ESR1 (0.65) | ESR1ESR2KDM4EALDH1A1TP53 | |
| SCHEMBL8808818 | 0.91 | LTA4H (0.55) | ESR1ESR2KDM4EALDH1A1TP53 | |
| SCHEMBL8809840 | 0.90 | LTA4H (0.56) | ESR1ESR2KDM4EALDH1A1TP53 | |
| SCHEMBL8810978 | 0.86 | ESR1 (0.66) | ESR1ESR2KDM4EALDH1A1TP53 | |
| SCHEMBL8811463 | 0.83 | ESR1 (0.61) | ESR1ESR2KDM4EALDH1A1TP53 | |
| SCHEMBL8808018 | 0.82 | ESR1 (0.61) | ESR1ESR2KDM4EALDH1A1TP53 | |
| SCHEMBL8809777 | 0.80 | CNR1 (0.56) | ALDH1A1CYP1A2 | |
| SCHEMBL1359959 | 0.80 | ESR1 (0.76) | ESR1ESR2KDM4E | |
| SCHEMBL699174 | 0.80 | ESR1 (0.76) | ESR1ESR2KDM4E | |
| SCHEMBL2475993 | 0.78 | ESR1 (0.75) | ESR1ESR2KDM4E |
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-1997004778-A1 | PYRIDINE COMPOUNDS, INTERMEDIATES, PROCESSES, COMPOSITIONS, AND METHODS | ELI LILLY AND COMPANY (US) | 1997-02-13 | — | — | WO | disclosed |