Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | SCN1A | P35498 | 1/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.43 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.43 |
| ▸ | ANPEP | P15144 | 2/20 | 0.42 |
| ▸ | ERAP2 | Q6P179 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3537247 | 0.79 | KDM4E (0.53) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL14634284 | 0.77 | KDM4E (0.52) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL3547551 | 0.77 | KDM4E (0.50) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL21518359 | 0.75 | KDM4E (0.48) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL21518446 | 0.75 | KDM4E (0.48) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL21623904 | 0.75 | KDM4E (0.48) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL4662686 | 0.75 | KDM4E (0.48) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL1202906 | 0.74 | KDM4E (0.47) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL3667979 | 0.73 | KDM4E (0.47) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL21518360 | 0.72 | KDM4E (0.46) | KDM4ELMNACYP1A2CYP2D6SCN1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3724251-A1 | IONIC HYDROPHILIZED POLYISOCYANATES, WATER CONTENT | Covestro Intellectual Property GmbH & Co. KG (DE) | 2020-10-21 | — | — | EP | disclosed |