Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 8/20 | 1.00 |
| ▸ | HTR2A | P28223 | 7/20 | 1.00 |
| ▸ | ADRA2A | P08913 | 7/20 | 1.00 |
| ▸ | HTR1A | P08908 | 5/20 | 0.76 |
| ▸ | HRH4 | Q9H3N8 | 7/20 | 0.71 |
| ▸ | DRD2 | P14416 | 3/20 | 0.71 |
| ▸ | HRH2 | P25021 | 2/20 | 0.61 |
| ▸ | HRH1 | P35367 | 2/20 | 0.61 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.61 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.61 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.61 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.61 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.61 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.61 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.61 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.61 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.61 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.61 |
| ▸ | DRD1 | P21728 | 1/20 | 0.61 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL9177904 | 0.91 | HTR2A (1.00) | DRD4HTR2AADRA2AHTR1AHRH4 | |
| Fumaric Acid SCHEMBL9177908 | 0.91 | HTR2A (1.00) | DRD4HTR2AADRA2AHTR1AHRH4 | |
| Fumaric Acid SCHEMBL29552949 | 0.91 | HTR2A (1.00) | DRD4HTR2AADRA2AHTR1AHRH4 | |
| SCHEMBL9213677 | 0.88 | DRD4 (0.78) | DRD4HTR2AADRA2AHTR1AHRH4 | |
| SCHEMBL9215929 | 0.87 | DRD4 (0.78) | DRD4HTR2AADRA2AHTR1AHRH4 | |
| SCHEMBL9218566 | 0.84 | DRD4 (0.73) | DRD4HTR2AADRA2AHTR1AHRH4 | |
| SCHEMBL11341734 | 0.84 | DRD4 (0.72) | DRD4HTR2AADRA2AHTR1AHRH4 | |
| Isoloxapine SCHEMBL2738975 | 0.83 | HRH4 (1.00) | DRD4HTR2AADRA2AHTR1AHRH4 | |
| SCHEMBL7410631 | 0.82 | HRH4 (0.84) | DRD4HTR2AADRA2AHTR1AHRH4 | |
| SCHEMBL7404036 | 0.81 | HRH4 (0.85) | DRD4HTR2AADRA2AHTR1AHRH4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0607129-B1 | METHYLPIPERAZINOAZEPINE DERIVATIVES, THEIR PREPARATION AND USE | THERABEL RESEARCH SA (BE) | 1995-08-23 | — | — | EP | claimed |
| EP-0607129-B1 | METHYLPIPERAZINOAZEPINE DERIVATIVES, THEIR PREPARATION AND USE | THERABEL RESEARCH SA (BE) | 1995-08-23 | — | — | EP | disclosed |
| EP-0607129-A1 | METHYLPIPERAZINOAZEPINE DERIVATIVES, THEIR PREPARATION AND USE. | THERABEL RESEARCH SA (BE) | 1994-07-27 | — | — | EP | disclosed |
| WO-1993007143-A1 | METHYLPIPERAZINOAZEPINE DERIVATIVES, THEIR PREPARATION AND USE | THERABEL RESEARCH S.A./N.V. (BE) | 1993-04-15 | — | — | WO | disclosed |