Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 7/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4416002 | 1.00 | TAAR1 (0.56) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL4587339 | 1.00 | TAAR1 (0.56) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL10302995 | 0.85 | TAAR1 (0.59) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL1130128 | 0.85 | TAAR1 (0.59) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL820194 | 0.85 | TAAR1 (0.59) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL248238 | 0.85 | TAAR1 (0.59) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL4126618 | 0.84 | TAAR1 (0.42) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL13788689 | 0.82 | TAAR1 (0.56) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL4413913 | 0.81 | TAAR1 (0.54) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL4413909 | 0.81 | TAAR1 (0.54) | TAAR1MAPTALDH1A1NPC1RAB9A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105237552-A | Oxazoline ring-containing amino tocopheroxyl zinc/magnesium complexes and preparation method and application thereof | UNIV EAST CHINA SCIENCE & TECH | 2016-01-13 | — | — | CN | disclosed |
| EP-0915699-A4 | STEREOSELECTIVE SYNTHESIS OF ENDOTHELIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2008-06-25 | — | — | EP | disclosed |
| US-6162932-A | Stereoselective synthesis of endothelin receptor antagonists | SMITHKLINE BEECHAM CORPORATION (US) | 2000-12-19 | — | — | US | disclosed |
| US-6080862-A | PREPARING (1S, 2R, 3S)-3-(2-HYDROXYETH-1-YLOXY)-4-METHOXYPHENYL) 1-(3,4-METHYLENEDIOXYPHENYL) 5-(PROP-1-YLOXY)INDANE-2-CARBOXYLIC ACID | SMITHKLINE BEECHAM CORPORATION (US) | 2000-06-27 | — | — | US | disclosed |
| EP-0915699-A1 | STEREOSELECTIVE SYNTHESIS OF ENDOTHELIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-05-19 | — | — | EP | disclosed |
| WO-1997017071-A1 | STEREOSELECTIVE SYNTHESIS OF ENDOTHELIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1997-05-15 | — | — | WO | disclosed |