Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MME | P08473 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ACE | P12821 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7649111 | 0.86 | CNR2 (0.50) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL14350869 | 0.86 | MME (0.58) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL12661114 | 0.85 | CTSS (0.51) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL12661102 | 0.85 | CTSS (0.51) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL24233257 | 0.84 | TSHR (0.51) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL16509240 | 0.84 | TSHR (0.51) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL13227756 | 0.84 | TSHR (0.51) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL19557763 | 0.84 | CNR2 (0.53) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL4028404 | 0.82 | ALDH1A1 (0.57) | ALDH1A1MMENPC1RAB9APOLB | |
| SCHEMBL4291861 | 0.82 | ALDH1A1 (0.57) | ALDH1A1MMENPC1RAB9APOLB |
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-2010139707-A1 | 2-AMINOOXAZOLINES AS TAAR1 LIGANDS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-12-09 | — | — | WO | disclosed |