Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | PIK3R5 | Q8WYR1 | 1/20 | 0.37 |
| ▸ | PIK3R3 | Q92569 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2840559 | 0.88 | TP53 (0.48) | PTGS1PTGS2THRBTP53MAPT | |
| SCHEMBL9831045 | 0.86 | MAPT (0.50) | PTGS1PTGS2THRBTP53MAPT | |
| SCHEMBL9834290 | 0.86 | TP53 (0.52) | PTGS1PTGS2THRBTP53MAPT | |
| SCHEMBL9833791 | 0.86 | THRB (0.45) | PTGS1PTGS2THRBTP53MAPT | |
| SCHEMBL9832344 | 0.84 | PIK3CD (0.43) | PTGS1PTGS2THRBTP53MAPT | |
| SCHEMBL9833432 | 0.81 | MAPT (0.44) | PTGS1PTGS2THRBTP53MAPT | |
| SCHEMBL9831400 | 0.80 | TP53 (0.38) | PTGS1PTGS2TP53MAPTKDM4E | |
| SCHEMBL9832942 | 0.78 | PTGS1 (0.44) | PTGS1PTGS2THRBTP53MAPT | |
| SCHEMBL9834063 | 0.78 | THRB (0.63) | THRBTP53MAPTRAB9AL3MBTL1 | |
| SCHEMBL9834001 | 0.77 | MEN1 (0.48) | PTGS1PTGS2THRBTP53MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0274443-B1 | HETEROARYL 3-OXO-PROPANENITRILE DERIVATIVES AND PROCESS FOR THEIR PREPARATION | FARMITALIA CARLO ERBA S.r.l. (IT) | 1991-05-29 | — | — | EP | disclosed |
| US-4816467-A | BACTERICIDES, VIRICIDES | FARMITALIA CARLO ERBA S.R.L (IT) | 1989-03-28 | — | — | US | disclosed |