Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ANPEP | P15144 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11355863 | 0.81 | RAB9A (0.45) | CYP1A2CYP2C19SMN1; SMN2ALDH1A1ANPEP | |
| SCHEMBL11474403 | 0.79 | ALDH1A1 (0.47) | CYP1A2CYP2C19ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL2168306 | 0.79 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL7514319 | 0.79 | ALDH1A1 (0.47) | CYP1A2CYP2C19ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL11355072 | 0.78 | ANPEP (0.43) | CYP1A2CYP2C19SMN1; SMN2ALDH1A1ANPEP | |
| SCHEMBL10391564 | 0.78 | ALDH1A1 (0.46) | SMN1; SMN2ALDH1A1KDM4EHSD17B10MAPT | |
| SCHEMBL7246198 | 0.77 | PAM (0.41) | CYP1A2CYP2C19SMN1; SMN2ANPEPTDP1 | |
| SCHEMBL6753261 | 0.77 | SMN1; SMN2 (0.38) | CYP1A2CYP2C19SMN1; SMN2ALDH1A1ANPEP | |
| SCHEMBL487420 | 0.77 | KMT2A (0.55) | ALDH1A1KDM4ETDP1HSD17B10MEN1 | |
| SCHEMBL24947662 | 0.77 | IMPDH2 (0.45) | ALDH1A1KDM4ETDP1MAPTKMT2A |
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-2003104167-A2 | CYANOHYDRIN ETHERS AND ESTERS AS HIGH-SENSITIVITY ENZYME SUBSTRATES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2003-12-18 | — | — | WO | disclosed |