Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 9/20 | 0.62 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 2/20 | 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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL7320673 | 0.95 | KDM4E (0.61) | LTA4HHRH3KCNH2 | |
| SCHEMBL7315210 | 0.91 | KDM4E (0.60) | LTA4HHRH3KCNH2TMEM97SIGMAR1 | |
| SCHEMBL7322566 | 0.90 | TMEM97 (0.61) | HRH3KCNH2TMEM97SIGMAR1 | |
| Hydrochloric Acid SCHEMBL7322523 | 0.90 | KDM4E (0.59) | LTA4HHRH3KCNH2TMEM97SIGMAR1 | |
| Hydrochloric Acid SCHEMBL7320603 | 0.89 | TMEM97 (0.60) | HRH3KCNH2TMEM97SIGMAR1 | |
| SCHEMBL7403252 | 0.88 | HRH3 (0.73) | LTA4HHRH3KCNH2TMEM97SIGMAR1 | |
| SCHEMBL7322766 | 0.88 | HRH3 (0.65) | LTA4HHRH3KCNH2TMEM97SIGMAR1 | |
| Hydrochloric Acid SCHEMBL7451311 | 0.87 | HRH3 (0.71) | LTA4HHRH3KCNH2TMEM97SIGMAR1 | |
| Hydrochloric Acid SCHEMBL9528804 | 0.87 | HRH3 (0.64) | LTA4HHRH3KCNH2TMEM97SIGMAR1 | |
| Hydrochloric Acid SCHEMBL7327685 | 0.85 | HRH3 (0.60) | LTA4HHRH3KCNH2TMEM97SIGMAR1 |
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-1992002502-A1 | N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1992-02-20 | — | — | WO | claimed |
| EP-0542846-A1 | N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1993-05-26 | — | — | EP | disclosed |