Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.78 |
| ▸ | GAA | P10253 | 2/20 | 0.78 |
| ▸ | MAPT | P10636 | 2/20 | 0.78 |
| ▸ | PKM | P14618 | 2/20 | 0.78 |
| ▸ | PLA2G2A | P14555 | 12/20 | 0.76 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.71 |
| ▸ | TSHR | P16473 | 2/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL4363430 | 0.90 | PLA2G2A (0.79) | ALDH1A1GAAMAPTPKMPLA2G2A | |
| SCHEMBL7701611 | 0.88 | MAPT (1.00) | ALDH1A1GAAMAPTPKMPLA2G2A | |
| SCHEMBL7694912 | 0.86 | PLA2G2A (0.77) | ALDH1A1GAAMAPTPKMPLA2G2A | |
| SCHEMBL337183 | 0.85 | PLA2G2A (0.59) | ALDH1A1GAAMAPTPKMPLA2G2A | |
| SCHEMBL16344540 | 0.85 | GAA (0.77) | ALDH1A1GAAMAPTPKMPLA2G2A | |
| SCHEMBL8645997 | 0.84 | PLA2G2A (0.83) | ALDH1A1MAPTPKMPLA2G2APLA2G1B | |
| SCHEMBL7963016 | 0.83 | PLA2G2A (1.00) | ALDH1A1MAPTPKMPLA2G2APLA2G1B | |
| SCHEMBL7953243 | 0.81 | PLA2G2A (1.00) | PLA2G2APLA2G1B | |
| SCHEMBL6820689 | 0.81 | PLA2G2A (0.68) | ALDH1A1MAPTPKMPLA2G2APLA2G1B | |
| SCHEMBL7961561 | 0.81 | PLA2G2A (1.00) | PLA2G2APLA2G1B |
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-2002020478-A1 | N-BENZYLINDOLE-3-ACETIC ACID DERIVATIVES FOR USE IN THE TREATMENT OF DRUG RESISTAN CANCER | DUBLIN CITY UNIVERSITY (IE) | 2002-03-14 | — | — | WO | disclosed |