Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.57 |
| ▸ | HTR2A | P28223 | 3/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.57 |
| ▸ | HTR2B | P41595 | 3/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.57 |
| ▸ | HTR1A | P08908 | 2/20 | 0.57 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.57 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.57 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.57 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.57 |
| ▸ | CNR1 | P21554 | 2/20 | 0.57 |
| ▸ | HTR2C | P28335 | 2/20 | 0.57 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.57 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.57 |
| ▸ | ADRB3 | P13945 | 10/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 9/20 | 0.52 |
| ▸ | ADRB2 | P07550 | 8/20 | 0.52 |
| ▸ | PTGER1 | P34995 | 4/20 | 0.44 |
| ▸ | FNTA | P49354 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30680200 | 0.89 | HTR1A (0.72) | ADORA3SLC6A2HTR2ASLC6A4HTR2B | |
| SCHEMBL395859 | 0.89 | HTR1A (0.72) | ADORA3SLC6A2HTR2ASLC6A4HTR2B | |
| SCHEMBL9825303 | 0.84 | CYP2C9 (0.52) | ADORA3SLC6A2HTR2ASLC6A4HTR2B | |
| SCHEMBL9825196 | 0.83 | NR1I2 (0.59) | ADORA3SLC6A2HTR2ASLC6A4HTR2B | |
| Oxalic Acid SCHEMBL9825719 | 0.80 | CYP3A4 (0.48) | ADORA3SLC6A2HTR2ASLC6A4HTR2B | |
| SCHEMBL11090316 | 0.77 | NR1I2 (0.67) | ADORA3SLC6A2HTR2ASLC6A4HTR2B | |
| SCHEMBL9825308 | 0.76 | NR1I2 (0.58) | ADORA3SLC6A2HTR2ASLC6A4HTR2B | |
| SCHEMBL9825215 | 0.76 | ADRB2 (0.49) | ADORA3SLC6A2HTR2ASLC6A4HTR2B | |
| SCHEMBL8882786 | 0.76 | ADORA3 (0.55) | ADORA3SLC6A2HTR2ASLC6A4HTR2B | |
| SCHEMBL8882790 | 0.76 | ADORA3 (0.55) | ADORA3SLC6A2HTR2ASLC6A4HTR2B |
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 |
|---|---|---|---|---|---|---|---|
| JP-63146865-A | — | — | None | — | — | JP | disclosed |
| EP-0255243-B1 | AZOLE DERIVATIVES USEFUL FOR CONTROLLING PLANT DISEASES | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1991-05-29 | — | — | EP | disclosed |
| US-4780471-A | IMIDAZOLE OR TRIAZOLE DERIVATIVES | SHIONOGI & CO., LTD. (JP) | 1988-10-25 | — | — | US | disclosed |
| JP-S63146865-A | AZOLE DERIVATIVE, PRODUCTION THEREOF AND PLANT DISEASE PREVENTING AND EXTERMINATING AGENT CONTAINING SAID DERIVATIVE | SHIONOGI & CO LTD | 1988-06-18 | — | — | JP | disclosed |
| EP-0255243-A1 | Azole derivatives useful for controlling plant diseases | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1988-02-03 | — | — | EP | disclosed |