Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1932895 | 0.86 | CYP1A2 (0.62) | MAOAMAOBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21331798 | 0.85 | CYP1A2 (0.61) | MAOAMAOBDRD2DRD4CYP1A2 | |
| SCHEMBL3868680 | 0.81 | MAOA (0.50) | MAOAMAOBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11705911 | 0.81 | MAOB (0.62) | MAOAMAOBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9813446 | 0.80 | ALDH1A1 (0.50) | HTTMEN1RAB9AKMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL7440012 | 0.80 | SIGMAR1 (0.53) | HTTRAB9A | |
| SCHEMBL11867881 | 0.80 | KDM4E (0.60) | DRD2DRD3MEN1RAB9AKMT2A | |
| SCHEMBL19281457 | 0.80 | CYP4F2 (0.52) | MAOBDRD2DRD4HTTDRD3 | |
| SCHEMBL9808024 | 0.80 | KDM4E (0.59) | DRD2DRD4HTTDRD3MEN1 | |
| SCHEMBL9808069 | 0.80 | KDM4E (0.55) | DRD2DRD4HTTDRD3MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0301421-B1 | SULFUR COMPOUNDS, PROCESS FOR THEIR PREPARATION AND MEDICINES | Roche Diagnostics GmbH (DE) | 1991-08-28 | — | — | EP | disclosed |
| EP-0301421-A2 | Sulfur compounds, process for their preparation and medicines | Roche Diagnostics GmbH (DE) | 1989-02-01 | — | — | EP | disclosed |