Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 8/20 | 0.54 |
| ▸ | HTR6 | P50406 | 8/20 | 0.54 |
| ▸ | HTR1A | P08908 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 2/20 | 0.38 |
| ▸ | HTR1B | P28222 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 5/20 | 0.38 |
| ▸ | DRD2 | P14416 | 5/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1079153 | 1.00 | HTR7 (0.54) | HTR7HTR6HTR1AALDH1A1SMN1; SMN2 | |
| SCHEMBL996958 | 0.87 | HTR7 (0.47) | HTR7HTR6HTR1AALDH1A1SMN1; SMN2 | |
| SCHEMBL996959 | 0.87 | HTR7 (0.47) | HTR7HTR6HTR1AALDH1A1SMN1; SMN2 | |
| SCHEMBL998132 | 0.84 | ALDH1A1 (0.43) | HTR7HTR6HTR1AALDH1A1SMN1; SMN2 | |
| SCHEMBL991525 | 0.82 | HTR7 (0.47) | HTR7HTR6HTR1AALDH1A1SMN1; SMN2 | |
| SCHEMBL8645200 | 0.79 | HTR7 (0.48) | HTR7HTR6HTR1AALDH1A1HTR2A | |
| SCHEMBL8645197 | 0.79 | HTR7 (0.48) | HTR7HTR6HTR1AALDH1A1HTR2A | |
| SCHEMBL1002275 | 0.75 | HTR7 (0.42) | HTR7HTR6HTR1ASIGMAR1KMT2A | |
| SCHEMBL1002277 | 0.75 | HTR7 (0.42) | HTR7HTR6HTR1ASIGMAR1KMT2A | |
| SCHEMBL11539874 | 0.75 | TSHR (0.44) | HTR7HTR6HTR1AALDH1A1SMN1; SMN2 |
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-2456436-A1 | 3-PHENOXYMETHYLPYRROLIDINE COMPOUNDS | Theravance, Inc. (US) | 2012-05-30 | — | — | EP | disclosed |
| WO-2011011231-A1 | 3-PHENOXYMETHYLPYRROLIDINE COMPOUNDS | THERAVANCE, INC. (US) | 2011-01-27 | — | — | WO | disclosed |