Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.70 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.59 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.54 |
| ▸ | DRD2 | P14416 | 3/20 | 0.51 |
| ▸ | HTR1A | P08908 | 2/20 | 0.51 |
| ▸ | DRD1 | P21728 | 2/20 | 0.51 |
| ▸ | DRD5 | P21918 | 2/20 | 0.51 |
| ▸ | HTR2A | P28223 | 2/20 | 0.51 |
| ▸ | DRD3 | P35462 | 2/20 | 0.51 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10507686 | 0.95 | SIGMAR1 (0.63) | SIGMAR1KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2549429 | 0.89 | KCNH2 (0.71) | SIGMAR1KCNH2SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL5410232 | 0.88 | KCNH2 (0.69) | SIGMAR1KCNH2SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL2548737 | 0.88 | KCNH2 (0.69) | SIGMAR1KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL22813547 | 0.84 | SCN5A (0.71) | SIGMAR1SLC6A4SLC6A3SCN5ADRD2 | |
| SCHEMBL5752571 | 0.83 | KCNH2 (0.64) | SIGMAR1KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11630606 | 0.83 | SIGMAR1 (0.70) | SIGMAR1KCNH2SLC6A4MEN1NPC1 | |
| SCHEMBL15651128 | 0.83 | SIGMAR1 (0.70) | SIGMAR1KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9319743 | 0.83 | SIGMAR1 (0.70) | SIGMAR1KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13858201 | 0.83 | SIGMAR1 (0.70) | SIGMAR1KCNH2SLC6A2SLC6A4SLC6A3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1099692-B1 | N,N-SUBSTITUTED CYCLIC AMINE DERIVATIVES | EISAI CO LTD (JP) | 2006-05-03 | — | — | EP | disclosed |
| US-6737425-B1 | SUCH AS 1-((4-CYANO-5-METHYL-4-PHENYL)HEXYL)-4-(2-(4-FLUORO -PHENOXY)ETHYL)PIPERAZINE; NERVE SELECTIVE CALCIUM ANTAGONISTS | EISAI CO., LTD. (JP) | 2004-05-18 | — | — | US | disclosed |
| EP-1099692-A1 | N,N-SUBSTITUTED CYCLIC AMINE DERIVATIVES | Eisai Co., Ltd. (JP) | 2001-05-16 | — | — | EP | disclosed |