Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Acrylic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 6/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| Glycerin SCHEMBL7214468 | 0.89 | USP2 (0.42) | HSD17B10TDP1LMNATSHRHCAR2 | |
| Glycerin SCHEMBL7212820 | 0.89 | USP2 (0.42) | HSD17B10TDP1LMNATSHRHCAR2 | |
| 1,3-Butanediol SCHEMBL7212825 | 0.88 | HSD17B10 (0.41) | HSD17B10TDP1LMNATSHRHCAR2 | |
| Acrylic Acid SCHEMBL3641809 | 0.86 | LMNA (0.50) | HSD17B10LMNATSHRHCAR2HPGD | |
| Acrylic Acid SCHEMBL7786724 | 0.86 | LMNA (0.50) | HSD17B10LMNATSHRHCAR2HPGD | |
| Triethylene Glycol SCHEMBL27455720 | 0.85 | MEN1 (0.41) | HSD17B10TDP1LMNATSHRALDH1A1 | |
| Tetraethylene Glycol SCHEMBL8851396 | 0.85 | MEN1 (0.41) | HSD17B10TDP1LMNATSHRALDH1A1 | |
| Acrylic Acid SCHEMBL8850676 | 0.85 | MEN1 (0.41) | HSD17B10TDP1LMNATSHRALDH1A1 | |
| Acrylic Acid SCHEMBL23494792 | 0.85 | TDP1 (0.40) | HSD17B10TDP1LMNATSHRHCAR2 | |
| Propylene Glycol SCHEMBL122754 | 0.84 | HSD17B10 (0.52) | HSD17B10TDP1TSHRHCAR2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6624236-B1 | Sol-gel-condensable cyclosiloxane(meth) acrylates; dentistry | 3M ESPE AG (DE) | 2003-09-23 | — | — | US | disclosed |
| EP-1141094-B1 | CYCLOSILOXANE-BASED CROSS-LINKABLE MONOMERS, PRODUCTION THEREOF AND USE THEREOF IN POLYMERISABLE MATERIALS | 3M ESPE AG (DE) | 2002-07-24 | — | — | EP | disclosed |