Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.44 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6402895 | 0.88 | MAOA (0.50) | MAOAMAOBCYP1A2CYP2D6GRM2 | |
| SCHEMBL28633848 | 0.88 | KMT2A (0.50) | MAOAMAOBCYP1A2CYP2D6GRM2 | |
| SCHEMBL6125509 | 0.86 | KMT2A (0.51) | MAOAMAOBCYP1A2CYP2D6KMT2A | |
| SCHEMBL7595514 | 0.86 | CYP1A2 (0.45) | MAOAMAOBCYP1A2CYP2D6GRM2 | |
| SCHEMBL17162934 | 0.85 | HTR2A (0.50) | MAOAMAOBCYP1A2CYP2D6GRM2 | |
| SCHEMBL21436988 | 0.85 | GRM8 (0.51) | MAOAMAOBCYP1A2CYP2D6KMT2A | |
| SCHEMBL11994168 | 0.83 | CYP1A2 (0.50) | MAOAMAOBCYP1A2CYP2D6GRM2 | |
| SCHEMBL11615204 | 0.83 | HTR2A (0.55) | MAOAMAOBCYP1A2CYP2D6GRM2 | |
| SCHEMBL6731123 | 0.83 | MAOA (0.54) | MAOAMAOBCYP1A2CYP2D6GRM2 | |
| SCHEMBL8101911 | 0.78 | L3MBTL1 (0.47) | MAOAMAOBCYP1A2CYP2D6GRM2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8766242-B2 | Aromatic chalcogen compounds and their use | E I DU PONT DE NEMOURS AND COMPANY (US) | 2014-07-01 | — | — | US | disclosed |
| US-20120068166-A1 | AROMATIC CHALCOGEN COMPOUNDS AND THEIR USE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-03-22 | — | — | US | disclosed |
| US-8089064-B2 | Aromatic chalcogen compounds and their use | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-01-03 | — | — | US | disclosed |
| US-20090121627-A1 | AROMATIC CHALCOGEN COMPOUNDS AND THEIR USE | E. I. DU PONT DE NEMOURS AND COMPANY | 2009-05-14 | — | — | US | disclosed |
| US-7504769-B2 | Aromatic chalcogen compounds and their use | E. I. DU PONT DE NEMOURS + COMPANY (US) | 2009-03-17 | — | — | US | disclosed |