Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL8104964 | 1.00 | ALDH1A1 (0.49) | ALDH1A1CYP1A2GAAKMT2AMEN1 | |
| SCHEMBL9229478 | 0.88 | ALDH1A1 (0.39) | ALDH1A1CYP1A2GAAKMT2AMEN1 | |
| SCHEMBL20214571 | 0.86 | ALDH1A1 (0.57) | ALDH1A1CYP1A2GAAKMT2AMEN1 | |
| SCHEMBL20214572 | 0.86 | ALDH1A1 (0.57) | ALDH1A1CYP1A2GAAKMT2AMEN1 | |
| SCHEMBL7480455 | 0.82 | ALDH1A1 (0.43) | ALDH1A1GAAKMT2AMEN1HDAC6 | |
| SCHEMBL4237258 | 0.76 | ALDH1A1 (0.56) | ALDH1A1GAAKMT2AMEN1HDAC6 | |
| SCHEMBL9229475 | 0.76 | HPGD (0.39) | ALDH1A1CYP1A2KMT2AMEN1MAPT | |
| SCHEMBL7481341 | 0.74 | CNR1 (0.55) | ALDH1A1GAAKMT2AMEN1HDAC6 | |
| SCHEMBL6793363 | 0.72 | CYP1A2 (0.41) | ALDH1A1CYP1A2GAAKMT2AMEN1 | |
| SCHEMBL7486579 | 0.71 | CNR1 (0.59) | ALDH1A1GAAKMT2AMEN1HDAC6 |
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-5650519-A | Optically active 5, 5-disubstituted-3-(mono- or disubstituted amino)-2-thiohydantoin intermediates to fungicidal 2-imidazolin-5-ones | RHONE-POULENC AGROCHIMIE (FR) | 1997-07-22 | — | — | US | disclosed |