Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Acetone SCHEMBL17668914 | 0.98 | ALDH1A1 (0.39) | ALDH1A1TSHRTHRB | |
| SCHEMBL13756081 | 0.80 | ALDH1A1 (0.42) | ALDH1A1TSHRTHRBTDP1 | |
| SCHEMBL33779 | 0.78 | TSHR (0.47) | ALDH1A1TSHRTHRBTDP1 | |
| SCHEMBL8993196 | 0.78 | ALDH1A1 (0.41) | ALDH1A1TSHRTHRB | |
| SCHEMBL371301 | 0.75 | ALDH1A1 (0.38) | ALDH1A1TSHR | |
| Acetic Acid SCHEMBL28158416 | 0.75 | TSHR (0.44) | ALDH1A1TSHR | |
| SCHEMBL7124073 | 0.75 | TDP1 (0.44) | ALDH1A1TSHRTDP1 | |
| Water SCHEMBL10713209 | 0.75 | TSHR (0.46) | ALDH1A1TSHRTHRBTDP1 | |
| Ethylene SCHEMBL8934253 | 0.75 | TSHR (0.46) | ALDH1A1TSHRTHRBTDP1 | |
| SCHEMBL3504072 | 0.74 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104245655-B | The method for purifying crude acetone stream | 利安德化学技术有限公司 | 2017-06-23 | — | — | CN | disclosed |
| EP-2844631-B1 | METHOD OF PURIFYING CRUDE ACETONE STREAM | LYONDELL CHEMICAL TECH LP (US) | 2016-12-14 | — | — | EP | disclosed |
| CN-103030526-B | Method for preparing isopropanol by gas phase hydrogenation of acetone | CHINA PETROLEUM & CHEMICAL | 2015-07-08 | — | — | CN | disclosed |
| EP-2844631-A1 | METHOD OF PURIFYING CRUDE ACETONE STREAM | Lyondell Chemical Technology, L.P. (US) | 2015-03-11 | — | — | EP | disclosed |
| CN-104245655-A | Method of purifying crude acetone stream | LYONDELL CHEMICAL TECH LP | 2014-12-24 | — | — | CN | disclosed |
| US-20130296612-A1 | METHOD OF PURIFYING CRUDE ACETONE STREAM | LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) | 2013-11-07 | — | — | US | disclosed |
| WO-2013166130-A1 | METHOD OF PURIFYING CRUDE ACETONE STREAM | LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) | 2013-11-07 | — | — | WO | disclosed |
| CN-103030526-A | Method for preparing isopropanol by gas phase hydrogenation of acetone | CHINA PETROLEUM & CHEMICAL | 2013-04-10 | — | — | CN | disclosed |