Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 7/20 | 0.54 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.49 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.49 |
| ▸ | HTR3B | O95264 | 2/20 | 0.49 |
| ▸ | HTR3A | P46098 | 2/20 | 0.49 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.49 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | HTR1A | P08908 | 2/20 | 0.48 |
| ▸ | HTR7 | P34969 | 2/20 | 0.48 |
| ▸ | HTR6 | P50406 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | HTR2C | P28335 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19281815 | 0.88 | FAAH (0.65) | FAAHKDM4EUSP2ALDH1A1TSHR | |
| Piperidine SCHEMBL17460236 | 0.86 | ADRB1 (0.49) | FAAHADRB1HTR3EHTR3BHTR3A | |
| SCHEMBL2456271 | 0.79 | KDM4E (0.63) | FAAHADRB1HTR3EHTR3BHTR3A | |
| Piperidine SCHEMBL27934131 | 0.76 | HTR3E (0.69) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| Pyrrolidine SCHEMBL28859475 | 0.76 | HTR3E (0.69) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| Phenylpiperazine SCHEMBL3559958 | 0.76 | ADRB1 (0.83) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL21963816 | 0.75 | KDM4E (0.51) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL10510808 | 0.74 | KDM4E (0.58) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| Pyrrolidine SCHEMBL12503448 | 0.74 | HTR3E (0.72) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| Water SCHEMBL10512053 | 0.73 | KDM4E (0.56) | ADRB1HTR3EHTR3BHTR3AHTR3D |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016014975-A2 | UREA/CARBAMATES FAAH MAGL OR DUAL FAAH/MAGL INHIBITORS AND USES THEREOF | NORTHEASTERN UNIVERSITY (US) | 2016-01-28 | — | — | WO | disclosed |