Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 12/20 | 0.55 |
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 3/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9077109 | 0.81 | ESR1 (0.49) | ESR1ESR2 | |
| SCHEMBL229436 | 0.80 | ESR1 (0.49) | MCHR1LTA4HESR1ESR2ADORA2A | |
| SCHEMBL7625096 | 0.79 | ESR1 (0.64) | ESR1ESR2KCNH2ADORA2AHTR2C | |
| SCHEMBL7748492 | 0.77 | ESR1 (0.49) | ESR1ESR2 | |
| SCHEMBL7748549 | 0.76 | ESR1 (0.66) | LTA4HESR1ESR2KCNH2ADORA2A | |
| SCHEMBL7502124 | 0.75 | CYP19A1 (0.50) | ESR1ESR2GAA | |
| SCHEMBL7167628 | 0.74 | MEN1 (0.66) | ESR2GAAADORA1 | |
| SCHEMBL4651997 | 0.73 | ESR1 (0.64) | ESR1ESR2KCNH2ADORA2AHTR2C | |
| SCHEMBL8340721 | 0.73 | MEN1 (0.61) | ESR1ESR2GAA | |
| SCHEMBL2741668 | 0.73 | ESR1 (0.64) | MCHR1LTA4HESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6399778-B1 | CRYSTALLINE SOLVATE | ELI LILLY AND COMPANY | 2002-06-04 | — | — | US | disclosed |