Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 2/20 | 0.49 |
| ▸ | ESR1 | P03372 | 8/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.47 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.46 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.46 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL11601667 | 0.85 | ESR1 (0.51) | GCGRESR1ESR2LTA4HKCNH2 | |
| SCHEMBL11601880 | 0.84 | ESR1 (0.59) | GCGRESR1ESR2LTA4HPSMB1 | |
| SCHEMBL11602278 | 0.81 | LTA4H (0.51) | GCGRESR1ESR2ITGA4LTA4H | |
| SCHEMBL11600056 | 0.80 | LTA4H (0.56) | ESR1ESR2LTA4HKCNH2 | |
| SCHEMBL11600463 | 0.80 | HRH3 (0.51) | GCGRESR1ESR2LTA4HPSMB1 | |
| SCHEMBL11602157 | 0.80 | ITGA4 (0.60) | GCGRESR1ESR2ITGA4 | |
| SCHEMBL11625178 | 0.79 | GCGR (0.60) | GCGRESR1ESR2ITGA4LTA4H | |
| SCHEMBL11620616 | 0.79 | GCGR (0.60) | GCGRESR1ESR2ITGA4LTA4H | |
| SCHEMBL11600610 | 0.79 | LTA4H (0.44) | GCGRESR1ESR2ITGA4LTA4H | |
| SCHEMBL11599995 | 0.78 | LTA4H (0.53) | ESR1ESR2LTA4HPSMB1PSMB5 |
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-4075227-A | NONSTEROIDAL | ELI LILLY AND COMPANY (US) | 1978-02-21 | — | — | US | disclosed |