Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.55 |
| ▸ | GAA | P10253 | 4/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.45 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.45 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.44 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.44 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20393915 | 0.85 | ALDH1A1 (0.63) | ALDH1A1GAAPOLBHTTSMN1; SMN2 | |
| SCHEMBL10016684 | 0.74 | ALDH1A1 (0.54) | ALDH1A1GAAPOLBHTTSMN1; SMN2 | |
| SCHEMBL20388022 | 0.72 | SMN1; SMN2 (0.58) | ALDH1A1GAAPOLBHTTSMN1; SMN2 | |
| SCHEMBL20387957 | 0.71 | ALDH1A1 (0.72) | ALDH1A1GAAPOLBHTTSMN1; SMN2 | |
| SCHEMBL27083362 | 0.70 | RAB9A (0.52) | ALDH1A1GAAPOLBHTTSMN1; SMN2 | |
| SCHEMBL20393943 | 0.70 | ALDH1A1 (0.68) | ALDH1A1GAAPOLBHTTSMN1; SMN2 | |
| SCHEMBL20393922 | 0.70 | ALDH1A1 (0.68) | ALDH1A1GAAPOLBSMN1; SMN2LMNA | |
| SCHEMBL14365916 | 0.69 | ALDH1A1 (0.56) | ALDH1A1GAAPOLBHTTSMN1; SMN2 | |
| SCHEMBL20388024 | 0.69 | ALDH1A1 (0.68) | ALDH1A1GAAPOLBSMN1; SMN2LMNA | |
| SCHEMBL20387961 | 0.66 | ALDH1A1 (0.78) | ALDH1A1GAAPOLBHTTSMN1; SMN2 |
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-3351544-A1 | BENZENE DISULFONAMIDE FOR THE TREATMENT OF CANCER | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2018-07-25 | — | — | EP | disclosed |