Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.33 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7872806 | 1.00 | OR51E2 (0.33) | OR51E2GRIK1TSHRKDM4EALDH1A1 | |
| SCHEMBL7868911 | 0.80 | TSHR (0.36) | GRIK1TSHRKDM4EALDH1A1TP53 | |
| SCHEMBL7868913 | 0.80 | TSHR (0.36) | GRIK1TSHRKDM4EALDH1A1TP53 | |
| SCHEMBL2418563 | 0.78 | FFAR3 (0.35) | GRIK1TSHRKDM4E | |
| SCHEMBL7866399 | 0.78 | TSHR (0.35) | GRIK1TSHRKDM4E | |
| SCHEMBL2418566 | 0.78 | FFAR3 (0.35) | GRIK1TSHRKDM4E | |
| SCHEMBL7866400 | 0.78 | TSHR (0.35) | GRIK1TSHRKDM4E | |
| SCHEMBL7174695 | 0.75 | GRIK1 (0.53) | OR51E2GRIK1TSHRKDM4E | |
| SCHEMBL7861419 | 0.73 | GRIK1 (0.32) | GRIK1 | |
| SCHEMBL7866414 | 0.73 | MCL1 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1124786-A1 | PROCESS FOR THE PREPARATION AND USES OF DERIVATIVES OF ESTERS OF ALPHA-METHYLENE- BETA-HYDROXY ACIDS | Uniroyal Chemical Company, Inc. (US) | 2001-08-22 | — | — | EP | claimed |
| WO-2000027793-A1 | PROCESS FOR THE PREPARATION AND USES OF DERIVATIVES OF ESTERS OF ALPHA- METHYLENE- BETA- HYDROXY ACIDS | UNIROYAL CHEMICAL COMPANY, INC. (US) | 2000-05-18 | — | — | WO | claimed |
| US-6310237-B1 | REACTIONS OF ALPHA-UNSATURATED CARBOXY ACIDS, ESTERS, AMIDES OR THIOESTERS WITH OF 1.) A LEWIS ACID OR BASE OR 2.) HYDROGEN AND TRANSITION METALS OR THEIR OXIDES, OR 3.) ALKYL ALUMINUMS, ALKYL HYDRIDES, SOLUBLE NICKEL OR PALLADIUM SALTS | UNIROYAL CHEMICAL COMPANY, INC. | 2001-10-30 | — | — | US | disclosed |
| US-6147251-A | PREPARATION OF DERIVATIVES OF HALO-BUT-2-ENOIC ACIDS AND ESTERS HIGH IN 2-ENE CONTENT; CATALYST PROMOTERS IN ETHYLENE POLYMERIZATION AND COPOLYMERIZATION | UNIROYAL CHEMICAL COMPANY, INC. (US) | 2000-11-14 | — | — | US | disclosed |