Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.44 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.43 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LPL | P06858 | 2/20 | 0.41 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | LIN28A | Q9H9Z2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29951011 | 0.85 | KDM4E (0.52) | CYP2D6CYP2C9CYP2C19RECQLATM | |
| SCHEMBL6353060 | 0.82 | ENPP2 (0.55) | ENPP2KDM4ETSHRALDH1A1LPL | |
| SCHEMBL14129395 | 0.82 | RECQL (0.56) | CYP2D6CYP2C9CYP2C19RECQLATM | |
| SCHEMBL29953749 | 0.80 | ENPP2 (0.49) | CYP2D6CYP2C9CYP2C19ENPP2CXCR1 | |
| SCHEMBL3600311 | 0.79 | KDM4E (0.58) | CYP2D6CYP2C9CYP2C19RECQLATM | |
| SCHEMBL29955815 | 0.78 | CHRNB2 (0.62) | ENPP2CXCR1CXCR2KDM4EALDH1A1 | |
| SCHEMBL19492821 | 0.78 | ENPP2 (0.56) | ENPP2CXCR1CXCR2KDM4EALDH1A1 | |
| SCHEMBL30093166 | 0.77 | KDM4E (0.64) | CYP2D6CYP2C9CYP2C19RECQLATM | |
| SCHEMBL804182 | 0.77 | TDP1 (0.63) | CYP2D6CYP2C9CYP2C19RECQLATM | |
| SCHEMBL14129394 | 0.77 | CYP2D6 (0.56) | CYP2D6CYP2C9CYP2C19RECQLATM |
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 |