Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.58 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | NPY1R | P25929 | 1/20 | 0.55 |
| ▸ | LTA4H | P09960 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
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 SCHEMBL7322523 | 0.99 | KDM4E (0.59) | KDM4EALDH1A1LMNAKCNH2HRH3 | |
| Hydrochloric Acid SCHEMBL7327685 | 0.94 | HRH3 (0.60) | KDM4EALDH1A1LMNAKCNH2HRH3 | |
| SCHEMBL7326161 | 0.91 | LTA4H (0.62) | KCNH2HRH3TMEM97SIGMAR1LTA4H | |
| SCHEMBL7322566 | 0.90 | TMEM97 (0.61) | KCNH2HRH3TMEM97SIGMAR1 | |
| Hydrochloric Acid SCHEMBL7320603 | 0.89 | TMEM97 (0.60) | KCNH2HRH3TMEM97SIGMAR1 | |
| SCHEMBL9529314 | 0.88 | KCNH2 (0.58) | KDM4EALDH1A1LMNAKCNH2HRH3 | |
| SCHEMBL7322766 | 0.88 | HRH3 (0.65) | KCNH2HRH3TMEM97SIGMAR1NPC1 | |
| Hydrochloric Acid SCHEMBL7450563 | 0.87 | KDM4E (0.66) | KDM4EALDH1A1LMNAKCNH2HRH3 | |
| Hydrochloric Acid SCHEMBL9528804 | 0.87 | HRH3 (0.64) | KCNH2HRH3TMEM97SIGMAR1NPC1 | |
| Oxalic Acid SCHEMBL7320673 | 0.86 | KDM4E (0.61) | KDM4EALDH1A1LMNAKCNH2HRH3 |
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 |
| 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 | disclosed |