Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 1/20 | 0.54 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.52 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 4/20 | 0.47 |
| ▸ | MAOA | P21397 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8980717 | 0.85 | ENPP2 (0.56) | ENPP2SGMS2TRPM8NR1I2NR3C1 | |
| SCHEMBL3811276 | 0.85 | KDM4E (0.60) | ENPP2SGMS2TRPM8NR1I2NR3C1 | |
| SCHEMBL8980585 | 0.84 | ABCB1 (0.52) | HTR1AADRA1AKDM4ENPC1RAB9A | |
| Water SCHEMBL8980780 | 0.81 | CAPN1 (0.49) | KDM4ERAB9APARP1 | |
| SCHEMBL1388211 | 0.80 | PTGER1 (0.60) | ENPP2SGMS2NR1I2NR3C1HTR1A | |
| SCHEMBL27702468 | 0.79 | PARP1 (0.65) | ENPP2SGMS2TRPM8NR1I2NR3C1 | |
| SCHEMBL8980684 | 0.79 | ALDH1A1 (0.54) | SGMS2TRPM8MAOBMAOAKDM4E | |
| Water SCHEMBL8980731 | 0.77 | KDM4E (0.47) | KDM4ERXRANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1097731 | 0.75 | KDM4E (0.55) | ENPP2SGMS2HTR1AADRA1AMAOB | |
| SCHEMBL3813996 | 0.74 | MRGPRX4 (0.59) | ENPP2MAOBMAOAKDM4EFFAR1 |
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-0711288-A1 | PIPERAZINE DERIVATIVES AS ALPHA 1A-ADRENERGIC RECEPTOR ANTAGONISTS | RECORDATI INDUSTRIA CHIMICA E FARMACEUTICA S.p.a. (IT) | 1996-05-15 | — | — | EP | disclosed |
| WO-1995004049-A1 | PIPERAZINE DERIVATIVES AS α1A-ADRENERGIC RECEPTOR ANTAGONISTS | RECORDATI S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) | 1995-02-09 | — | — | WO | disclosed |