Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of O-Xylene. 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 | 2/20 | 0.59 |
| ▸ | ACHE | P22303 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| O-Xylene SCHEMBL38665313 | 0.94 | TSHR (0.59) | TSHRACHEHPGDHSD17B10ALDH1A1 | |
| O-Xylene SCHEMBL29221594 | 0.81 | TSHR (0.77) | TSHRACHEHSD17B10ALDH1A1CA1 | |
| Toluene SCHEMBL27535892 | 0.80 | LMNA (0.61) | TSHRACHEHPGDALDH1A1CA1 | |
| SCHEMBL1022378 | 0.79 | TSHR (0.41) | TSHRACHEHPGDHSD17B10ALDH1A1 | |
| Phosphoric Acid SCHEMBL31614546 | 0.79 | TSHR (0.41) | TSHRACHEHPGDHSD17B10ALDH1A1 | |
| O-Xylene SCHEMBL17338002 | 0.79 | TSHR (0.62) | TSHRACHEHPGDHSD17B10ALDH1A1 | |
| O-Xylene SCHEMBL1502379 | 0.79 | TSHR (0.62) | TSHRACHEHPGDALDH1A1CA1 | |
| O-Xylene SCHEMBL17255245 | 0.79 | TSHR (0.62) | TSHRACHEHPGDALDH1A1CA1 | |
| O-Xylene SCHEMBL29498826 | 0.79 | TSHR (0.62) | TSHRACHEHPGDALDH1A1CA1 | |
| O-Xylene SCHEMBL29061119 | 0.79 | TSHR (0.62) | TSHRACHEHPGDALDH1A1CA1 |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105505319-A | Efficient ceramic grinding agent | WANG LU | 2016-04-20 | — | — | CN | claimed |
| CN-105132200-A | Lavender incense textile cleaning agent and preparation method therefor | BENBU DONGFANG GOLD RIVER WOOLEN CO LTD | 2015-12-09 | — | — | CN | claimed |
| CN-105505319-A | Efficient ceramic grinding agent | WANG LU | 2016-04-20 | — | — | CN | disclosed |
| CN-105505319-A | Efficient ceramic grinding agent | WANG LU | 2016-04-20 | — | — | CN | disclosed |
| CN-105132200-A | Lavender incense textile cleaning agent and preparation method therefor | BENBU DONGFANG GOLD RIVER WOOLEN CO LTD | 2015-12-09 | — | — | CN | disclosed |
| CN-105132200-A | Lavender incense textile cleaning agent and preparation method therefor | BENBU DONGFANG GOLD RIVER WOOLEN CO LTD | 2015-12-09 | — | — | CN | disclosed |
| CN-104877764-A | Machinery oil stain cleaning agent | QINGDAO QIANFAN HI TECH CO LTD | 2015-09-02 | — | — | CN | disclosed |
| CN-104877764-A | Machinery oil stain cleaning agent | QINGDAO QIANFAN HI TECH CO LTD | 2015-09-02 | — | — | CN | disclosed |
| CN-104877784-A | Feather dress detergent | QINGDAO TUOLIAN INFORMATION TECHNOLOGY CO LTD | 2015-09-02 | — | — | CN | disclosed |
| CN-104877784-A | Feather dress detergent | QINGDAO TUOLIAN INFORMATION TECHNOLOGY CO LTD | 2015-09-02 | — | — | CN | disclosed |
| CN-104212360-A | Improved equipment abrasive | QINGDAO CHENGTIAN WEIYE MACHINERY MFG CO LTD | 2014-12-17 | — | — | CN | disclosed |
| CN-104212360-A | Improved equipment abrasive | QINGDAO CHENGTIAN WEIYE MACHINERY MFG CO LTD | 2014-12-17 | — | — | CN | disclosed |
| CN-104194722-A | Grinding agent for mechanical equipment | QINGDAO QIYUAN ZHENDONG ELECTRIC CO LTD | 2014-12-10 | — | — | CN | disclosed |
| CN-104164319-A | Oil stain treating agent | QINGDAO QIYUAN ZHENDONG ELECTRIC CO LTD | 2014-11-26 | — | — | CN | disclosed |
| CN-102851140-A | Heavy-duty liquid laundry detergent | Qidong wanlong electric light source co ltd | 2013-01-02 | — | — | CN | disclosed |
| US-4776974-A | MIXTURE WITH MONO-(OR DI)CARBOXYLIC ACID | DIVERSEY WYANDOTTE CORPORATION (US) | 1988-10-11 | — | — | US | disclosed |
| US-4715980-A | FOOD PREPARATION AND HANDLING EQUIPMENT | DIVERSEY WYANDOTTE CORPORATION (US) | 1987-12-29 | — | — | US | disclosed |