Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20715967 | 0.94 | ALDH1A1 (0.37) | ALDH1A1CYP1A2CYP2C19KDM4EPOLB | |
| SCHEMBL14740848 | 0.89 | CYP1A2 (0.45) | ALDH1A1CYP1A2CYP2C19KDM4EPOLB | |
| SCHEMBL20715971 | 0.88 | HPGD (0.36) | ALDH1A1KDM4ECYP3A4HPGDL3MBTL1 | |
| SCHEMBL29368049 | 0.88 | CYP1A2 (0.44) | ALDH1A1CYP1A2CYP2C19KDM4EPOLB | |
| SCHEMBL19182697 | 0.86 | SMN1; SMN2 (0.46) | ALDH1A1CYP1A2CYP2C19CYP3A4RECQL | |
| SCHEMBL20715963 | 0.83 | ALDH1A1 (0.42) | ALDH1A1CYP1A2CYP2C19KDM4EPOLB | |
| SCHEMBL25633562 | 0.83 | BCL2 (0.46) | ALDH1A1CYP1A2CYP2C19KDM4EPOLB | |
| SCHEMBL20715968 | 0.83 | CYP1A2 (0.41) | ALDH1A1CYP1A2CYP2C19KDM4EPOLB | |
| SCHEMBL20715972 | 0.81 | SLC22A12 (0.36) | ALDH1A1CYP1A2CYP2C19KDM4EPOLB | |
| SCHEMBL20715653 | 0.80 | TRPA1 (0.45) | ALDH1A1CYP1A2CYP2C19KDM4EPOLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019025575-A1 | PROCESSES FOR PREPARING COMPLEXES COMPRISING RHODIUM(II) AND CARBOXYLATE LIGANDS | STOCKHOLM UNIVERSITY HOLDING AB (SE) | 2019-02-07 | — | — | WO | disclosed |
| WO-2017129991-A2 | PROCESSES FOR PREPARING STERICALLY CONGESTED DICARBOXYLIC ACID LIGANDS AND PRODUCTS THEREOF | STOCKHOLM UNIVERSITY HOLDING AB (SE) | 2017-08-03 | — | — | WO | disclosed |