Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 6/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL7868956 | 1.00 | ALDH1A1 (0.44) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL7868942 | 0.81 | ALDH1A1 (0.46) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL27968231 | 0.76 | ALDH1A1 (0.55) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL7869622 | 0.74 | — | — | |
| SCHEMBL28370362 | 0.70 | ALDH1A1 (0.50) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL7869596 | 0.69 | ATM (0.43) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL17841694 | 0.69 | ATM (0.43) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL7868969 | 0.69 | ATM (0.35) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL2415369 | 0.68 | ALDH1A1 (0.48) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL7861414 | 0.68 | ALDH1A1 (0.48) | ALDH1A1ATMTSHRHPGDHCAR2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| 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 | 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 |
| 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 | disclosed |