Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 3/20 | 0.56 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 8/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | EBP | Q15125 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8808818 | 0.99 | LTA4H (0.55) | LTA4HMCHR1ESR1ESR2HRH3 | |
| SCHEMBL8810633 | 0.91 | ESR1 (0.65) | ESR1ESR2MAPTKDM4EALDH1A1 | |
| SCHEMBL8809777 | 0.90 | CNR1 (0.56) | HRH3ALDH1A1CYP1A2KCNH2SIGMAR1 | |
| SCHEMBL8809268 | 0.90 | ESR1 (0.65) | ESR1ESR2MAPTKDM4EALDH1A1 | |
| SCHEMBL8807859 | 0.88 | LTA4H (0.56) | LTA4HMCHR1ESR1ESR2HRH3 | |
| SCHEMBL8809238 | 0.84 | LTA4H (0.58) | LTA4HMCHR1ESR1HRH3KCNH2 | |
| SCHEMBL8810553 | 0.83 | LTA4H (0.52) | LTA4HMCHR1ESR1ESR2HRH3 | |
| SCHEMBL7443460 | 0.81 | LTA4H (0.77) | LTA4HMCHR1ESR1HRH3MAPT | |
| SCHEMBL21121895 | 0.78 | LTA4H (0.55) | LTA4HMCHR1ESR1ESR2HRH3 | |
| SCHEMBL8809349 | 0.78 | ESR1 (0.49) | LTA4HMCHR1ESR1ESR2HRH3 |
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 |