Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30115040 | 0.87 | ALDH1A1 (0.56) | KEAP1SMN1; SMN2ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL24299608 | 0.85 | KEAP1 (0.46) | KEAP1SMN1; SMN2ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL7887988 | 0.84 | GNAO1 (0.54) | KEAP1SMN1; SMN2ALDH1A1CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL8901169 | 0.82 | GNAO1 (0.56) | KEAP1SMN1; SMN2ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL9740021 | 0.81 | KEAP1 (0.68) | KEAP1SMN1; SMN2ALDH1A1CYP1A2HPGD | |
| SCHEMBL9738476 | 0.81 | KEAP1 (0.68) | KEAP1SMN1; SMN2ALDH1A1CYP1A2HPGD | |
| SCHEMBL16173592 | 0.81 | KEAP1 (0.68) | KEAP1SMN1; SMN2ALDH1A1CYP1A2HPGD | |
| SCHEMBL7103406 | 0.81 | KEAP1 (0.68) | KEAP1SMN1; SMN2ALDH1A1CYP1A2HPGD | |
| SCHEMBL11609926 | 0.81 | KEAP1 (0.68) | KEAP1SMN1; SMN2ALDH1A1CYP1A2HPGD | |
| SCHEMBL7895241 | 0.81 | ALDH1A1 (0.57) | KEAP1SMN1; SMN2ALDH1A1CYP1A2CYP2D6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3083408-B1 | FILLING DEVICE AND USE THEREOF FOR FILLING A FLUID | MERCK PATENT GMBH (DE) | 2018-02-21 | — | — | EP | disclosed |