Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.66 |
| ▸ | MAOB | P27338 | 1/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | ACHE | P22303 | 1/20 | 0.60 |
| ▸ | PDE4A | P27815 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.60 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.60 |
| ▸ | GPR35 | Q9HC97 | 11/20 | 0.57 |
| ▸ | CA12 | O43570 | 2/20 | 0.56 |
| ▸ | CA1 | P00915 | 2/20 | 0.56 |
| ▸ | CA2 | P00918 | 2/20 | 0.56 |
| ▸ | CA3 | P07451 | 2/20 | 0.56 |
| ▸ | CA6 | P23280 | 2/20 | 0.56 |
| ▸ | CA5A | P35218 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL9187739 | 0.83 | GPR35 (0.79) | MAOAMAOBTSHRGPR35CA12 | |
| SCHEMBL7066529 | 0.81 | GPR35 (0.77) | MAOAMAOBTSHRGPR35CA12 | |
| SCHEMBL7062287 | 0.80 | GPR35 (0.56) | MAOAMAOBTSHRGPR35CA12 | |
| SCHEMBL982766 | 0.80 | CA12 (0.68) | MAOAGPR35CA12CA1CA2 | |
| SCHEMBL9319388 | 0.77 | GPR35 (0.82) | GPR35CA12CA1CA2CA3 | |
| SCHEMBL10586869 | 0.76 | MAOA (0.66) | MAOAMAOBCYP1A2CYP3A4CYP2D6 | |
| Methoxsalen SCHEMBL2302069 | 0.76 | CYP3A4 (1.00) | MAOAMAOBCYP1A2CYP3A4CYP2D6 | |
| Methoxsalen SCHEMBL29376525 | 0.76 | CYP3A4 (1.00) | MAOAMAOBCYP1A2CYP3A4CYP2D6 | |
| Methoxsalen SCHEMBL19168 | 0.76 | CYP3A4 (1.00) | MAOAMAOBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9387172 | 0.75 | MAOA (0.64) | MAOAMAOBCYP1A2CYP3A4CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4150042-A | 6-Hydroxy-7-methoxy-5-benzofuran carboxaldehyde and 2,3-dihydro-7-methoxy-6-benzofuranol | HOFFMANN-LA ROCHE INC. (US) | 1979-04-17 | — | — | US | disclosed |
| US-4147703-A | Process to produce 8-methoxypsoralen | HOFFMANN-LA ROCHE INC. (US) | 1979-04-03 | — | — | US | disclosed |
| US-4107182-A | 7-Oxo-9-methoxy-7H-furo[3,2-g][1]benzopyran-6-carboxylic acid | HOFFMANN-LA ROCHE INC. (US) | 1978-08-15 | — | — | US | disclosed |
| US-4107182-A | 7-Oxo-9-methoxy-7H-furo[3,2-g][1]benzopyran-6-carboxylic acid | HOFFMANN-LA ROCHE INC. (US) | 1978-08-15 | — | — | US | disclosed |