Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.88 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | THRB | P10828 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.32 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| 2-Ethoxyethanol SCHEMBL27745970 | 0.94 | ALDH1A1 (0.78) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL485434 | 0.94 | ALDH1A1 (0.88) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL9432157 | 0.94 | ALDH1A1 (1.00) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL11024472 | 0.94 | ALDH1A1 (1.00) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL9547497 | 0.94 | ALDH1A1 (1.00) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL4686 | 0.94 | — | — | |
| Diethylene Glycol Monoethyl Ether SCHEMBL28095824 | 0.91 | ALDH1A1 (0.82) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL8056895 | 0.90 | ALDH1A1 (0.93) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL337831 | 0.90 | — | — | |
| 2-Ethoxyethanol SCHEMBL10491734 | 0.90 | ALDH1A1 (0.93) | ALDH1A1TSHRMAPK1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006057904-A1 | STEREOSELECTIVE PREPARATION OF 4-ARYL PIPERIDINE AMIDES BY ASYMMETRIC HYDROGENATION OF A PROCHIRAL ENAMIDE AND INTERMEDIATES OF THIS PROCESS | MERCK & CO., INC. (US) | 2006-06-01 | — | — | WO | disclosed |
| US-5281264-A | Salt of disazo acid dye containing pyrrazole ring and basic dye, inks | ORIENT CHEMICAL INDUSTRIES, LTD. (JP) | 1994-01-25 | — | — | US | disclosed |
| WO-1989009206-A1 | ACRYLAMIDE DERIVATIVE COMPOSITION, STABLE IN STORAGE AND TO BE USED FOR GENERATING IMMOBILIZED pH GRADIENTS | PHARMACIA AB (SE) | 1989-10-05 | — | — | WO | disclosed |