Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.39 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | IMPDH2 | P12268 | 3/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | EP300 | Q09472 | 1/20 | 0.34 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.34 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL419728 | 0.82 | KDM4E (0.58) | KDM4EMAPKAPK2LMNACYP1A2CYP3A4 | |
| SCHEMBL29954125 | 0.82 | KDM4E (0.58) | KDM4EMAPKAPK2LMNACYP1A2CYP3A4 | |
| SCHEMBL112184 | 0.81 | PRKCZ (0.42) | KDM4EMAPKAPK2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29694473 | 0.81 | PRKCZ (0.42) | KDM4EMAPKAPK2CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL2548053 | 0.80 | KDM4E (0.56) | KDM4EMAPKAPK2LMNACYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL29956365 | 0.80 | KDM4E (0.56) | KDM4EMAPKAPK2LMNACYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL29951532 | 0.79 | PRKCZ (0.41) | KDM4EMAPKAPK2CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL951403 | 0.79 | PRKCZ (0.41) | KDM4EMAPKAPK2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29420009 | 0.78 | KDM4E (0.40) | KDM4EMAPKAPK2LMNACYP1A2CYP3A4 | |
| SCHEMBL28718090 | 0.78 | KDM4E (0.40) | KDM4EMAPKAPK2LMNACYP1A2CYP3A4 |
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 |