Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.48 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | PTGER1 | P34995 | 10/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.39 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
| ▸ | KDM5A | P29375 | 1/20 | 0.38 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4067016 | 0.87 | KDM1A (0.51) | KDM1AENPP2PTGER1ADORA3ALDH1A1 | |
| SCHEMBL2634947 | 0.81 | ALDH1A1 (0.46) | ADORA3ALDH1A1GAA | |
| SCHEMBL1686371 | 0.81 | TSHR (0.49) | ENPP2GAACYP1A2CYP2D6LMNA | |
| SCHEMBL29952519 | 0.81 | TSHR (0.49) | ENPP2GAACYP1A2CYP2D6LMNA | |
| SCHEMBL25308686 | 0.79 | ENPP2 (0.41) | ENPP2ADORA3TBXA2RCYP1A2CYP2D6 | |
| SCHEMBL20704942 | 0.78 | ENPP2 (0.44) | ENPP2LMNA | |
| SCHEMBL29950945 | 0.78 | KDM4E (0.45) | ENPP2ALDH1A1CYP1A2CYP2D6LMNA | |
| SCHEMBL29447064 | 0.78 | ENPP2 (0.44) | ENPP2LMNA | |
| SCHEMBL20804852 | 0.77 | KDM1A (0.51) | KDM1APTGER1ADORA3ALDH1A1GAA | |
| SCHEMBL15330282 | 0.77 | PLAU (0.44) | ENPP2ALDH1A1KDM4CCYP1A2CYP2D6 |
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 |