Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 3/20 | 0.39 |
| ▸ | CES1 | P23141 | 3/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Heptane SCHEMBL538473 | 1.00 | TSHR (0.50) | TSHRALDH1A1THRBLMNAEPHX1 | |
| Nonane SCHEMBL8960871 | 1.00 | TSHR (0.50) | TSHRALDH1A1THRBLMNAEPHX1 | |
| Heptane SCHEMBL25303431 | 0.97 | ALDH1A1 (0.47) | TSHRALDH1A1THRBLMNAEPHX1 | |
| Heptane SCHEMBL4434566 | 0.97 | ALDH1A1 (0.47) | TSHRALDH1A1THRBLMNAEPHX1 | |
| Hexane SCHEMBL5237862 | 0.97 | ALDH1A1 (0.53) | TSHRALDH1A1THRBLMNAEPHX1 | |
| Hexane SCHEMBL22134480 | 0.97 | ALDH1A1 (0.53) | TSHRALDH1A1THRBLMNAEPHX1 | |
| Hexane SCHEMBL224276 | 0.97 | ALDH1A1 (0.53) | TSHRALDH1A1THRBLMNAEPHX1 | |
| Hexane SCHEMBL14895621 | 0.97 | ALDH1A1 (0.53) | TSHRALDH1A1THRBLMNAEPHX1 | |
| Nonane SCHEMBL9452411 | 0.94 | TSHR (0.44) | TSHRALDH1A1THRBLMNACES2 | |
| Heptane SCHEMBL21580605 | 0.94 | TSHR (0.44) | TSHRALDH1A1THRBLMNACES2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1304320-B1 | Preparation of esters of carboxylic acids | EASTMAN CHEM CO (US) | 2008-05-28 | — | — | EP | disclosed |
| CN-1297532-C | Preparation of carboxylic acid ester | EASTMAN CHEM CO (US) | 2007-01-31 | — | — | CN | disclosed |
| EP-1304320-A2 | Preparation of esters of carboxylic acids | EASTMAN CHEMICAL COMPANY (US) | 2003-04-23 | — | — | EP | disclosed |
| CN-1412172-A | Preparation of carboxylic acid ester | EASTMAN CHEM CO (US) | 2003-04-23 | — | — | CN | disclosed |
| US-6518454-B1 | A process wherein a solution of a carboxylic acid in a first solvent and an alcohol are fed to a simulated moving bed reactor (SMBR) containing a solid(s) to produce a first stream comprising a solution of an ester of the carboxylic acid with | EASTMAN CHEMICAL COMPANY | 2003-02-11 | — | — | US | disclosed |
| US-4585591-A | 17β-ethynylsteroids and process for preparing same | MITSUBISHI CHEMICAL INDUSTRIES, LTD. (JP) | 1986-04-29 | — | — | US | disclosed |
| EP-0071178-B1 | ACYLOXYSTEROIDS AND PROCESS FOR PRODUCING SAME | MITSUBISHI KASEI CORPORATION (JP) | 1985-10-16 | — | — | EP | disclosed |
| EP-0053845-B1 | 17-BETA-ETHYNYLSTEROIDS AND PROCESS FOR PREPARING SAME | MITSUBISHI KASEI CORPORATION (JP) | 1985-04-10 | — | — | EP | disclosed |
| US-4440689-A | Acyloxysteroids and process for producing same | MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) | 1984-04-03 | — | — | US | disclosed |
| EP-0071178-A1 | Acyloxysteroids and process for producing same | MITSUBISHI KASEI CORPORATION (JP) | 1983-02-09 | — | — | EP | disclosed |
| EP-0053845-A1 | 17-Beta-ethynylsteroids and process for preparing same | MITSUBISHI KASEI CORPORATION (JP) | 1982-06-16 | — | — | EP | disclosed |