Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPK13 | O15264 | 5/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 5/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 5/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.36 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | GCGR | P47871 | 4/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9772563 | 0.81 | ALDH1A1 (0.44) | PTGS2MAPTKDM4EALDH1A1GAA | |
| SCHEMBL9772462 | 0.79 | HSD17B10 (0.40) | KDM4EALDH1A1GAAALDH1A3NPC1 | |
| SCHEMBL9772437 | 0.78 | RAB9A (0.44) | MAPTKDM4EALDH1A1GAAALDH1A3 | |
| SCHEMBL9772745 | 0.77 | KDM4E (0.51) | KDM4EALDH1A1GAANPC1LMNA | |
| SCHEMBL9772463 | 0.77 | GAA (0.38) | MAPTKDM4EALDH1A1GAANPC1 | |
| SCHEMBL4562282 | 0.74 | KDM4E (0.34) | KDM4EALDH1A1GAARAB9A | |
| SCHEMBL9772915 | 0.69 | MAPT (0.36) | PTGS2PTGS1MAPTKDM4EALDH1A1 | |
| SCHEMBL9772661 | 0.68 | MAPT (0.36) | PTGS2PTGS1MAPTKDM4EALDH1A1 | |
| SCHEMBL4216197 | 0.68 | TRPV1 (0.44) | MAPTKDM4EALDH1A1MAPK13MAPK12 | |
| SCHEMBL31612814 | 0.68 | TUBB4A (0.45) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5041442-A | Antiulcer agents | SYNTEX (U.S.A.) INC. (US) | 1991-08-20 | — | — | US | disclosed |