Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA13 | Q8N1Q1 | 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 | |
|---|---|---|---|---|
| SCHEMBL29671321 | 1.00 | NPC1 (0.47) | NPC1MAOAMAOBGAAMAPT | |
| SCHEMBL22909578 | 0.80 | CA2 (0.61) | NPC1MAPTKDM4ESMN1; SMN2L3MBTL1 | |
| SCHEMBL22909163 | 0.78 | TSHR (0.49) | NPC1GAAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL29671325 | 0.78 | TSHR (0.49) | NPC1GAAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL22909370 | 0.76 | SMN1; SMN2 (0.43) | MAOBGAAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL29671271 | 0.76 | SMN1; SMN2 (0.43) | MAOBGAAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL22909392 | 0.75 | CA2 (0.53) | GAAMAPTKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL29671317 | 0.75 | CA2 (0.53) | GAAMAPTKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL28762114 | 0.74 | KDM4E (0.49) | NPC1MAOAMAOBGAAMAPT | |
| SCHEMBL22909364 | 0.73 | CA2 (0.54) | CA12CA1CA2CA7CA13 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021009568-A1 | BENZENESULFONAMIDE DERIVATIVES AND USES THEREOF | 2692372 ONTARIO, INC. (CA) | 2021-01-21 | — | — | WO | disclosed |