Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 11/20 | 0.37 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 3/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6065338 | 0.87 | NOX1 (0.35) | MAOABCHENOX1PTGS1PTGS2 | |
| SCHEMBL5602981 | 0.82 | ALDH1A1 (0.38) | MAOABCHEKDM1AACHEALDH1A1 | |
| SCHEMBL5600043 | 0.82 | BCHE (0.36) | MAOABCHENOX1ALDH1A1CYP1A2 | |
| SCHEMBL5603210 | 0.77 | MAOA (0.42) | MAOABCHENOX1KDM1APTGS1 | |
| SCHEMBL5602850 | 0.74 | BIRC5 (0.34) | MAOA | |
| SCHEMBL6064976 | 0.74 | BCHE (0.33) | BCHEALDH1A1CYP1A2CYP3A4THRB | |
| SCHEMBL6064959 | 0.74 | ALDH1A1 (0.35) | BCHENOX1ACHEALDH1A1CYP1A2 | |
| SCHEMBL14380204 | 0.73 | MAOA (0.33) | MAOANOX1ALDH1A1KMT2A | |
| SCHEMBL3687303 | 0.72 | CYP1A2 (0.39) | ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL14380198 | 0.72 | MAOA (0.39) | MAOABCHENOX1KDM1AACHE |
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 3 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-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 |