Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | GLA | P06280 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.45 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2633118 | 0.93 | KDM4E (0.47) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL12948863 | 0.90 | KDM4E (0.46) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL2633133 | 0.89 | KDM4E (0.46) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL22170182 | 0.88 | KDM4E (0.44) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL22139741 | 0.88 | KDM4E (0.45) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL10076374 | 0.87 | KDM4E (0.47) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL16745455 | 0.86 | BCHE (0.45) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL2627650 | 0.85 | KDM4E (0.50) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL280329 | 0.85 | KDM4E (0.46) | ALDH1A1KDM4EGAAGLAHPGD | |
| Hydrochloric Acid SCHEMBL15550063 | 0.85 | BCHE (0.45) | ALDH1A1KDM4EGAAGLAHPGD |
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-7727738-B2 | Methods for generating analogs of coenzyme A | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2010-06-01 | — | — | US | disclosed |