Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 12/20 | 0.47 |
| ▸ | HTR2C | P28335 | 12/20 | 0.47 |
| ▸ | HTR2B | P41595 | 12/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9047228 | 0.88 | TRPM8 (0.45) | HTR2AHTR2CHTR2BTRPM8HTR1A | |
| SCHEMBL9046497 | 0.87 | HTR2A (0.46) | HTR2AHTR2CHTR2BL3MBTL1HTR1A | |
| SCHEMBL8828132 | 0.86 | MAPT (0.44) | — | |
| SCHEMBL8828377 | 0.86 | CYP3A4 (0.50) | OPRM1 | |
| SCHEMBL8828424 | 0.86 | SMPD1 (0.50) | HTR2AHTR2CHTR2BL3MBTL1 | |
| SCHEMBL9044808 | 0.84 | HTR2A (0.49) | HTR2AHTR2CHTR2BL3MBTL1HTR1A | |
| SCHEMBL8828540 | 0.84 | HTR2A (0.49) | HTR2AHTR2CHTR2BL3MBTL1HTR1A | |
| SCHEMBL8828215 | 0.84 | CYP3A4 (0.41) | HTR2AHTR2CHTR2BHTR1ASLC6A4 | |
| SCHEMBL8828324 | 0.83 | HTR2A (0.48) | HTR2AHTR2CHTR2BL3MBTL1HTR1A | |
| SCHEMBL8828397 | 0.81 | L3MBTL1 (0.60) | HTR2AHTR2CHTR2BL3MBTL1HTR1A |
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-5607953-A | ANTIISCHEMIC AGENTS | EISAI CO., LTD. (JP) | 1997-03-04 | — | — | US | disclosed |
| EP-0344577-B1 | Butenoic or propenoic acid derivatives | EISAI CO LTD (JP) | 1996-10-09 | — | — | EP | disclosed |
| US-5382595-A | Antiischemic agents | EISAI CO., LTD. (JP) | 1995-01-17 | — | — | US | disclosed |
| US-5177089-A | Antiischemic agent, vasodilator | EISAI CO., LTD. (JP) | 1993-01-05 | — | — | US | disclosed |
| EP-0344577-A2 | Butenoic or propenoic acid derivatives | Eisai Co., Ltd. (JP) | 1989-12-06 | — | — | EP | disclosed |