Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1074128 | 0.94 | — | — | |
| SCHEMBL31151133 | 0.92 | THRB (0.39) | ALDH1A1TSHRTHRBMEN1HTT | |
| SCHEMBL5174030 | 0.92 | — | — | |
| SCHEMBL9579658 | 0.90 | THRB (0.43) | ALDH1A1TSHRTHRBMEN1HTT | |
| SCHEMBL6151432 | 0.90 | THRB (0.43) | ALDH1A1TSHRTHRBMEN1HTT | |
| 1-Bromobutane SCHEMBL8575882 | 0.86 | THRB (0.39) | ALDH1A1TSHRTHRBMEN1HTT | |
| SCHEMBL3332189 | 0.86 | — | — | |
| SCHEMBL11296839 | 0.85 | TSHR (0.33) | TSHRTHRBMEN1HTTKMT2A | |
| SCHEMBL15922787 | 0.84 | MEN1 (0.38) | ALDH1A1TSHRTHRBMEN1HTT | |
| SCHEMBL9444828 | 0.83 | ALDH1A1 (0.39) | ALDH1A1TSHRTHRBMEN1HTT |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-58152829-A | — | — | None | — | — | JP | disclosed |
| EP-0816362-A1 | THIAZOLE DERIVATIVES | TAISHO PHARMACEUTICAL CO. LTD (JP) | 1998-01-07 | — | — | EP | disclosed |
| EP-0430065-B1 | Barbiturate assay compositions and methods | ABBOTT LAB (US) | 1995-11-15 | — | — | EP | disclosed |
| US-5099020-A | Immunoassay with fluorescent compounds | ABBOTT LABORATORIES (US) | 1992-03-24 | — | — | US | disclosed |
| US-5096838-A | Fluorescent tracers for detection of barbiturates and for antiserums | ABBOTT LABORATORIES (US) | 1992-03-17 | — | — | US | disclosed |
| EP-0430065-A2 | Barbiturate assay compositions and methods | ABBOTT LABORATORIES (US) | 1991-06-05 | — | — | EP | disclosed |
| JP-S58152829-A | 1,2,3,7,8,8A-HEXAHYDRO-1-HYDROXY-7-METHYL-8-(3'-HYDROXY) PROPYLNAPHTHALENE | SUNTORY LTD | 1983-09-10 | — | — | JP | disclosed |
| US-4014946-A | Synthesis of 1-bromonon-4-en-6-yne | ZOECON CORPORATION (US) | 1977-03-29 | — | — | US | disclosed |
| US-3994896-A | Sulfonate esters of non-4-en-6-yn-1-ol | ZOECON CORPORATION (US) | 1976-11-30 | — | — | US | disclosed |
| US-3985813-A | Unsaturated alcohols | ZOECON CORPORATION (US) | 1976-10-12 | — | — | US | disclosed |
| US-3954818-A | Synthesis of non-4-en-6-ynoic acid ester | ZOECON CORPORATION (US) | 1976-05-04 | — | — | US | disclosed |