Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.60 |
| ▸ | CASP1 | P29466 | 1/20 | 0.60 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 4/20 | 0.36 |
| ▸ | CES1 | P23141 | 4/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL28180405 | 1.00 | TSHR (0.60) | TSHRCASP1THRBLMNACES2 | |
| Octane SCHEMBL28993765 | 0.89 | TSHR (0.47) | TSHRCASP1THRBLMNACES2 | |
| SCHEMBL8470522 | 0.81 | TSHR (0.45) | TSHRCASP1NAAA | |
| Hexane SCHEMBL10567935 | 0.78 | — | — | |
| Hexane SCHEMBL29173170 | 0.78 | TSHR (0.41) | TSHRTHRBLMNACES2CES1 | |
| SCHEMBL2765 | 0.78 | — | — | |
| SCHEMBL28124906 | 0.78 | — | — | |
| Hexane SCHEMBL3357674 | 0.75 | TSHR (0.39) | TSHRTHRBLMNACES2CES1 | |
| Hexane SCHEMBL6756710 | 0.75 | TSHR (0.39) | TSHRTHRBLMNACES2CES1 | |
| Hexane SCHEMBL10390111 | 0.75 | NAAA (0.44) | TSHRTHRBLMNACES2CES1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110270065-A | Golf with sandwich layer outside foaming inner core and thermosetting property | 阿库施耐特公司 | 2019-09-24 | — | — | CN | disclosed |
| CN-105646817-B | Polycarbonate diol, process for producing the same, and polyurethane and active energy ray-curable polymer composition each comprising the same | 三菱化学株式会社 | 2019-08-13 | — | — | CN | disclosed |
| CN-104689530-B | The multi-layer golf ball of foamed core with optional distribution of weight | 阿库施耐特公司 | 2017-12-15 | — | — | CN | disclosed |
| CN-105646817-A | Polycarbonate diol, process for producing the same, and polyurethane and active energy ray-curable polymer composition each comprising the same | 三菱化学株式会社 | 2016-06-08 | — | — | CN | disclosed |