Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 9/20 | 0.52 |
| ▸ | HTR2A | P28223 | 5/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 2/20 | 0.39 |
| ▸ | NOS1 | P29475 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18509385 | 0.86 | HTR2A (0.62) | TAAR1HTR2ACYP2A6CYP1A2KDM4E | |
| SCHEMBL18924648 | 0.84 | HRH3 (0.41) | TAAR1HTR2ALOXL2NOS3NOS1 | |
| SCHEMBL24741509 | 0.84 | HRH3 (0.41) | TAAR1HTR2ALOXL2NOS3NOS1 | |
| Hydrochloric Acid SCHEMBL23246035 | 0.82 | TAAR1 (0.54) | TAAR1HTR2ACYP2A6CYP1A2KDM4E | |
| SCHEMBL27718310 | 0.82 | CA2 (0.46) | HTR2AKDM4EALDH1A1ADRA2ASLC6A2 | |
| SCHEMBL9746668 | 0.81 | RIPK1 (0.43) | TAAR1SMN1; SMN2 | |
| SCHEMBL2407454 | 0.79 | GRIA4 (0.42) | TAAR1ALDH1A1L3MBTL1KMT2ATDP1 | |
| SCHEMBL20758394 | 0.79 | GRIA4 (0.42) | TAAR1ALDH1A1L3MBTL1KMT2ATDP1 | |
| SCHEMBL18685712 | 0.79 | TSHR (0.48) | TAAR1CYP2A6ALDH1A1L3MBTL1TDP1 | |
| SCHEMBL717640 | 0.77 | TAAR1 (0.56) | TAAR1HTR2ACYP2A6CYP1A2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2619184-B1 | DEUBIQUITINASE INHIBITORS AND METHODS FOR USE OF THE SAME | UNIV MICHIGAN REGENTS (US) | 2018-05-23 | — | — | EP | disclosed |