Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 5/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.36 |
| ▸ | LIMK2 | P53671 | 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 | |
|---|---|---|---|---|
| SCHEMBL29955140 | 0.85 | NR3C1 (0.40) | PSIP1NR3C1KCNQ2ALDH1A1TP53 | |
| SCHEMBL29955167 | 0.82 | NR3C1 (0.39) | NR3C1KCNQ2ALDH1A1MAPTKCNA5 | |
| SCHEMBL29953387 | 0.77 | AKR1B1 (0.39) | PSIP1CYP2C19ALDH1A1TP53GAA | |
| SCHEMBL11571083 | 0.76 | MAPT (0.42) | NR3C1KCNQ2ALDH1A1TP53GAA | |
| SCHEMBL1122639 | 0.76 | PTK2B (0.49) | PSIP1CYP2C19ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL7264830 | 0.75 | ALDH1A1 (0.51) | ALDH1A1MAPTLIMK2 | |
| SCHEMBL29955893 | 0.74 | NR3C1 (0.42) | NR3C1KCNQ2ALDH1A1TP53GAA | |
| SCHEMBL27836542 | 0.73 | ALDH1A1 (0.44) | KCNQ2ALDH1A1TP53GAAMAPT | |
| SCHEMBL11506985 | 0.73 | MAPT (0.60) | CYP2C19ALDH1A1GAAMAPTSMN1; SMN2 | |
| SCHEMBL29955273 | 0.72 | KCNQ2 (0.56) | KCNQ2CYP2C19ALDH1A1TP53GAA |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |