Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.49 |
| ▸ | TACR2 | P21452 | 2/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | SHBG | P04278 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.49 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | TST | Q16762 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL17439642 | 0.89 | HTR2A (0.59) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL8028842 | 0.89 | HTR2A (0.59) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL4063423 | 0.89 | HTR2A (0.59) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL16668623 | 0.89 | HTR2A (0.59) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL9137110 | 0.89 | HTR2A (0.59) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL8091009 | 0.88 | HTR2A (0.56) | HTR2AESR1ADRA2AADORA3TACR2 | |
| Hydrogen Peroxide SCHEMBL9347625 | 0.86 | ALDH1A1 (0.60) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL8090819 | 0.82 | UCHL3 (0.56) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL9875584 | 0.80 | HTR2A (0.50) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL1611347 | 0.79 | IDO1 (0.39) | HTR2AESR1ADRA2AADORA3TACR2 |
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-0511879-B1 | Pyrazine derivatives | OTSUKA PHARMA CO LTD (JP) | 1995-03-22 | — | — | EP | disclosed |
| EP-0511879-A1 | Pyrazine derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1992-11-04 | — | — | EP | disclosed |