Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 12/20 | 0.73 |
| ▸ | LTA4H | P09960 | 4/20 | 0.67 |
| ▸ | ACHE | P22303 | 2/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.58 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.58 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.58 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.58 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.58 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7451311 | 0.99 | HRH3 (0.71) | HRH3LTA4HACHEKCNH2HRH4 | |
| Hydrochloric Acid SCHEMBL7450563 | 0.90 | KDM4E (0.66) | HRH3LTA4HACHEKCNH2HRH4 | |
| SCHEMBL7326161 | 0.88 | LTA4H (0.62) | HRH3LTA4HKCNH2TMEM97SIGMAR1 | |
| SCHEMBL7398931 | 0.88 | HRH3 (0.89) | HRH3LTA4HKCNH2HRH4PSMB1 | |
| Hydrochloric Acid SCHEMBL7397621 | 0.86 | HRH3 (0.86) | HRH3LTA4HKCNH2HRH4PSMB1 | |
| SCHEMBL8640984 | 0.85 | HRH3 (0.89) | HRH3LTA4HKCNH2HRH4PSMB1 | |
| SCHEMBL8637452 | 0.85 | HRH3 (1.00) | HRH3LTA4HACHEKCNH2PSMB1 | |
| Oxalic Acid SCHEMBL7320673 | 0.84 | KDM4E (0.61) | HRH3LTA4HKCNH2 | |
| SCHEMBL7142387 | 0.84 | HRH3 (0.97) | HRH3LTA4HACHEKCNH2PSMB1 | |
| SCHEMBL7402218 | 0.83 | HRH3 (0.75) | HRH3LTA4HACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995024390-A1 | NOVEL PHENYL(-ALKYL/ALKOXY)-1-AMINOALKYL-SUBSTITUTED PIPERIDINES AND PYRROLIDINES AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-09-14 | — | — | WO | claimed |
| WO-1995024390-A1 | NOVEL PHENYL(-ALKYL/ALKOXY)-1-AMINOALKYL-SUBSTITUTED PIPERIDINES AND PYRROLIDINES AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-09-14 | — | — | WO | disclosed |