Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8997666 | 0.93 | KEAP1 (0.41) | KEAP1SMN1; SMN2ALDH1A1MAPK1SIGMAR1 | |
| SCHEMBL1030003 | 0.87 | KEAP1 (0.54) | KEAP1SMN1; SMN2ALDH1A1MAPK1SIGMAR1 | |
| SCHEMBL28169793 | 0.85 | KEAP1 (0.52) | KEAP1SMN1; SMN2ALDH1A1MAPK1SIGMAR1 | |
| SCHEMBL11065 | 0.84 | KEAP1 (0.60) | KEAP1SMN1; SMN2ALDH1A1MAPK1SIGMAR1 | |
| SCHEMBL26621753 | 0.84 | KEAP1 (0.60) | KEAP1SMN1; SMN2ALDH1A1MAPK1SIGMAR1 | |
| Hydrochloric Acid SCHEMBL10978 | 0.82 | KEAP1 (0.58) | KEAP1SMN1; SMN2ALDH1A1MAPK1SIGMAR1 | |
| SCHEMBL8997844 | 0.81 | PAOX (0.38) | ALDH1A1SIGMAR1HRH3USP2HPGD | |
| Hydrochloric Acid SCHEMBL23116183 | 0.81 | KEAP1 (0.56) | KEAP1SMN1; SMN2ALDH1A1MAPK1SIGMAR1 | |
| Hydrochloric Acid SCHEMBL8950153 | 0.80 | GLA (0.39) | KEAP1SMN1; SMN2ALDH1A1MAPK1SIGMAR1 | |
| SCHEMBL154374 | 0.78 | ALDH1A1 (0.46) | KEAP1SMN1; SMN2ALDH1A1MAPK1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5523303-A | ANTIULCER AND -SECRETORY AGENTS; GASTRIC H+K+ ATPASE INHIBITORS; NONTOXIC; OXIMES DERIVATIVES | EGIS GYOGYSZERGYAR RT. (HU) | 1996-06-04 | — | — | US | disclosed |
| EP-0619298-A2 | (Phenylmethylene)-2-(alkyl)-1- omega-(amino)-alkoxyimino -cycloalkane derivatives, a process for preparing them as well as medicaments containing them and the use of them | EGIS GYOGYSZERGYAR RT. (HU) | 1994-10-12 | — | — | EP | disclosed |