Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of 2-Hydroxybenzoic Acid Butyl Ester. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.75 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.75 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.75 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.68 |
| ▸ | TP53 | P04637 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | LMNA | P02545 | 4/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | ESR1 | P03372 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.53 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.53 |
| ▸ | CNR2 | P34972 | 1/20 | 0.52 |
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-Hydroxybenzoic Acid Butyl Ester SCHEMBL27913511 | 1.00 | TSHR (0.75) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL29672357 | 1.00 | TSHR (0.75) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL62565 | 0.97 | TSHR (0.80) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL29421150 | 0.97 | TSHR (0.80) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL5526965 | 0.95 | TSHR (0.77) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL1640149 | 0.95 | TSHR (0.77) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL3362976 | 0.95 | TSHR (0.77) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL8013639 | 0.95 | TSHR (0.77) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL29613017 | 0.95 | TSHR (0.77) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL27838988 | 0.95 | TSHR (0.77) | TSHRTDP1L3MBTL1MAPK1CYP3A4 |
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-3840958-A1 | IMPROVED METHOD FOR THE PARTIAL COLORING OF PLASTIC PARTS | Covestro Intellectual Property GmbH & Co. KG (DE) | 2021-06-30 | — | — | EP | disclosed |
| WO-2020039018-A1 | IMPROVED METHOD FOR THE PARTIAL COLORING OF PLASTIC PARTS | COVESTRO DEUTSCHLAND AG (DE) | 2020-02-27 | — | — | WO | disclosed |
| CN-101857546-B | Method for producing diaryl carbonates or alkyl aryl carbonates from dialkyl carbonates | BAYER MATERIALSCIENCE AG (DE) | 2015-10-07 | — | — | CN | disclosed |
| CN-101857546-A | Method for producing diaryl carbonates or alkyl aryl carbonates from dialkyl carbonates | BAYER MATERIALSCIENCE AG | 2010-10-13 | — | — | CN | disclosed |