Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 7/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GMNN | O75496 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13590952 | 0.86 | TAAR1 (0.52) | TAAR1MAPTTP53CYP1A2ALOX15 | |
| SCHEMBL297375 | 0.82 | PTPN7 (0.52) | NR3C2PTPN7DUSP3AR | |
| SCHEMBL8593058 | 0.81 | MAPT (0.46) | TAAR1MAPTTP53CYP1A2ALOX15 | |
| SCHEMBL2600223 | 0.80 | CTSS (0.46) | TP53HSD17B10SMN1; SMN2NR3C2PTPN7 | |
| SCHEMBL13359787 | 0.80 | TAAR1 (0.61) | TAAR1MAPTTP53CYP1A2ALOX15 | |
| SCHEMBL10662203 | 0.79 | PTPN7 (0.47) | NPSR1NR3C2PTPN7DUSP3AR | |
| SCHEMBL3244152 | 0.78 | TAAR1 (0.53) | TAAR1MAPTTP53ALOX15MAPK1 | |
| SCHEMBL20072550 | 0.77 | NR3C2 (0.44) | TAAR1NPSR1NR3C2PTPN7DUSP3 | |
| SCHEMBL20937969 | 0.77 | TAAR1 (0.57) | TAAR1MAPTTP53CYP1A2ALOX15 | |
| SCHEMBL3637053 | 0.77 | NR3C2 (0.49) | MAPTKDM4EALDH1A1NR3C2PTPN7 |
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-2200982-A1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2010-06-30 | — | — | EP | disclosed |
| WO-2009033995-A1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-03-19 | — | — | WO | disclosed |