Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | DHX9 | Q08211 | 1/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20117808 | 0.82 | KCNK2 (0.37) | ALDH1A1KDM4ELMNADRD3 | |
| SCHEMBL10093369 | 0.82 | HSD17B2 (0.56) | ALDH1A1SMN1; SMN2HSD17B2LMNAHPGD | |
| SCHEMBL2309959 | 0.81 | POLB (0.51) | ALDH1A1POLBHPGD | |
| SCHEMBL10093392 | 0.81 | POLB (0.51) | ALDH1A1POLBHPGD | |
| Amidephrine Mesylate SCHEMBL122479 | 0.76 | ADRB3 (0.58) | ALDH1A1SMN1; SMN2POLBKDM4ELMNA | |
| SCHEMBL1490877 | 0.76 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2POLBKEAP1NR3C1 | |
| SCHEMBL245468 | 0.76 | MEN1 (0.60) | ALDH1A1SMN1; SMN2POLBKEAP1HSD17B1 | |
| SCHEMBL10100499 | 0.75 | KEAP1 (0.55) | ALDH1A1SMN1; SMN2POLBKEAP1EGFR | |
| SCHEMBL13139256 | 0.75 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2POLBKEAP1NR3C1 | |
| SCHEMBL7108854 | 0.75 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2POLBKEAP1NR3C1 |
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-2349990-B1 | ARYL-PHENYL-SULFONAMIDE-PHENYLENE COMPOUNDS AND THEIR USE | PIMCO 2664 LTD (GB) | 2018-05-02 | — | — | EP | disclosed |