Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 7/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22260997 | 0.95 | GAA (0.34) | GAAHTTPKMKMT2AALDH1A1 | |
| SCHEMBL28473328 | 0.95 | GAA (0.36) | GAAHTTPKMKMT2AALDH1A1 | |
| SCHEMBL7766757 | 0.82 | GAA (0.36) | GAAHTTPKMKMT2AALDH1A1 | |
| SCHEMBL20291762 | 0.80 | ALDH1A1 (0.40) | GAAHTTPKMKMT2AALDH1A1 | |
| SCHEMBL224188 | 0.79 | HMGCR (0.37) | GAAHTTPKMKMT2AALDH1A1 | |
| SCHEMBL28484382 | 0.79 | GAA (0.32) | GAAHTTPKMKMT2AALDH1A1 | |
| SCHEMBL28848452 | 0.78 | GAA (0.36) | GAAHTTPKMKMT2AALDH1A1 | |
| SCHEMBL313286 | 0.78 | ALDH1A1 (0.36) | GAAHTTPKMKMT2AALDH1A1 | |
| SCHEMBL8771894 | 0.77 | GAA (0.32) | GAAHTTPKMKMT2AALDH1A1 | |
| SCHEMBL3450609 | 0.77 | ALDH1A1 (0.36) | GAAHTTPKMKMT2AALDH1A1 |
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-3684833-A1 | METHOD FOR PRODUCING POLYISOCYANATES OF (CYCLO)ALIPHATIC DIISOCYANATES WHICH ARE FLOCCULATION-STABLE IN SOLVENTS | BASF SE (DE) | 2020-07-29 | — | — | EP | disclosed |