Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.49 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7530267 | 0.86 | HTT (0.42) | NR1H4MAPTSMN1; SMN2LMNACYP1A2 | |
| SCHEMBL22959316 | 0.84 | NR1H4 (0.69) | NR1H4SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL18998671 | 0.83 | MEN1 (0.51) | PDE7AMAPTSMN1; SMN2HPGDLMNA | |
| SCHEMBL4961573 | 0.81 | PDE7A (0.42) | PDE7AMAPTSMN1; SMN2HPGDLMNA | |
| SCHEMBL7208834 | 0.81 | PDE7A (0.42) | PDE7AMAPTSMN1; SMN2HPGDLMNA | |
| SCHEMBL6273901 | 0.81 | ALDH1A1 (0.41) | PDE7AMAPTSMN1; SMN2HPGDLMNA | |
| SCHEMBL5324856 | 0.80 | ALDH1A1 (0.45) | NR1H4MAPTHPGDLMNACYP3A4 | |
| SCHEMBL4961567 | 0.80 | TLR9 (0.49) | PDE7AMAPTSMN1; SMN2HPGDLMNA | |
| SCHEMBL5327698 | 0.80 | RORC (0.62) | PDE7AMAPTSMN1; SMN2HPGDLMNA | |
| SCHEMBL6274128 | 0.80 | MAPT (0.43) | PDE7AMAPTSMN1; SMN2HPGDLMNA |
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-1183074-A1 | SUBSTITUTED BIARYL ETHER COMPOUNDS | UNIVERSITY OF TEXAS SOUTHWESTERN MEDICAL CENTER (US) | 2002-03-06 | — | — | EP | disclosed |
| WO-2000072920-A1 | SUBSTITUTED BIARYL ETHER COMPOUNDS | THE UNIVERSITY OF TEXAS SOUTHWESTERN MEDICAL CENTER (US) | 2000-12-07 | — | — | WO | disclosed |