Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5603527 | 0.87 | KDM4E (0.33) | KDM4ECYP1A2CYP2C19ATM | |
| SCHEMBL5600032 | 0.78 | RXFP1 (0.32) | MAPTCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL5600120 | 0.77 | ALDH1A1 (0.32) | KDM4EMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5601754 | 0.77 | CA1 (0.42) | KDM4EMAPTALDH1A1 | |
| SCHEMBL5603936 | 0.76 | KDM4E (0.31) | KDM4EMAPTCYP1A2CYP3A4CYP2D6 | |
| Chloromethane SCHEMBL5600647 | 0.76 | KDM4E (0.33) | KDM4EMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5601278 | 0.76 | KDM4E (0.31) | KDM4EMAPTCYP1A2CYP3A4CYP2D6 | |
| Fluoride Ion SCHEMBL5601530 | 0.74 | KDM4E (0.31) | KDM4EMAPTCYP1A2CYP3A4CYP2D6 | |
| Bromide SCHEMBL5601721 | 0.74 | KDM4E (0.31) | KDM4EMAPTCYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL5601267 | 0.74 | KDM4E (0.31) | KDM4EMAPTCYP1A2CYP3A4CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7276567-B2 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-10-02 | — | — | US | disclosed |
| US-20050261449-A1 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENT INC. | 2005-11-24 | — | — | US | disclosed |