Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 2/20 | 0.41 |
| ▸ | RORA | P35398 | 2/20 | 0.41 |
| ▸ | RORC | P51449 | 2/20 | 0.41 |
| ▸ | RORB | Q92753 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 6/20 | 0.41 |
| ▸ | CNR1 | P21554 | 4/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL11069837 | 0.92 | CYP3A4 (0.38) | ALDH1A1GAAPGRRORARORC | |
| SCHEMBL11067919 | 0.90 | RORA (0.43) | ALDH1A1GAAPGRRORARORC | |
| SCHEMBL3877954 | 0.90 | ALDH1A1 (0.38) | ALDH1A1PGRKDM4EHPGDLMNA | |
| SCHEMBL11064405 | 0.89 | CNR2 (0.40) | ALDH1A1CNR2CNR1SLC6A3HTT | |
| SCHEMBL11071245 | 0.85 | ALDH1A1 (0.35) | ALDH1A1PGRKDM4EHPGDPDE5A | |
| SCHEMBL11061257 | 0.84 | LMNA (0.38) | ALDH1A1KDM4ELMNACYP2C19NPSR1 | |
| SCHEMBL11063409 | 0.83 | RORA (0.38) | ALDH1A1GAARORARORCRORB | |
| SCHEMBL11063319 | 0.83 | ALDH1A1 (0.36) | ALDH1A1GAAPGRKDM4EHPGD | |
| SCHEMBL3873669 | 0.82 | SMN1; SMN2 (0.41) | ALDH1A1GAAKDM4ELMNAPOLB | |
| SCHEMBL29361500 | 0.82 | PGR (0.47) | ALDH1A1GAAPGRRORARORC |
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-4431819-A | PRESSURE AND HEAT SENSITIVE ELEMENTS; CARBONLESS COPYING; HECTOGRAPHY; XERORAPHY | STERLING DRUG INC. (US) | 1984-02-14 | — | — | US | disclosed |