Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of 1,2-Dichlorobenzene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | CES2 | O00748 | 3/20 | 0.52 |
| ▸ | CES1 | P23141 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.43 |
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| 1,2-Dichlorobenzene SCHEMBL27754908 | 1.00 | TSHR (0.59) | TSHRLMNAALDH1A1CES2CES1 | |
| 1,2-Dichlorobenzene SCHEMBL27435182 | 0.97 | TSHR (0.56) | TSHRLMNAALDH1A1CES2CES1 | |
| 1,2-Dichlorobenzene SCHEMBL29087567 | 0.97 | TSHR (0.56) | TSHRLMNAALDH1A1CES2CES1 | |
| 1,2-Dichlorobenzene SCHEMBL28208295 | 0.92 | TSHR (0.55) | TSHRLMNAALDH1A1CES2CES1 | |
| 1,2-Dichlorobenzene SCHEMBL27801440 | 0.91 | TSHR (0.62) | TSHRLMNAALDH1A1CES2CES1 | |
| 1,2-Dichlorobenzene SCHEMBL5147145 | 0.88 | TSHR (0.59) | TSHRLMNAALDH1A1CES2CES1 | |
| 1,2-Dichlorobenzene SCHEMBL27438550 | 0.88 | LMNA (0.47) | TSHRLMNAALDH1A1CES2CES1 | |
| 1,2-Dichlorobenzene SCHEMBL8356206 | 0.88 | TSHR (0.67) | TSHRLMNAALDH1A1CES2CES1 | |
| 1,2-Dichlorobenzene SCHEMBL27871244 | 0.88 | TSHR (0.67) | TSHRLMNAALDH1A1CES2CES1 | |
| 2-Chlorophenol SCHEMBL3363646 | 0.86 | ALDH1A1 (0.45) | TSHRLMNAALDH1A1CES2CES1 |
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 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108863774-A | A kind of 2,4 dichloro benzene chloroacetic chloride synthetic method | 石家庄市绿丰化工有限公司 | 2018-11-23 | — | — | CN | claimed |
| CN-107250102-A | Method for producing benzidine from azobenzene by ruthenium catalysis | 拜耳作物科学股份公司 | 2017-10-13 | — | — | CN | claimed |
| CN-104016977-B | A kind of replacement thiadiazine diketone derivative and preparation method thereof and application | 山东大学 | 2016-06-22 | — | — | CN | claimed |
| CN-103012296-B | A kind of synthetic method of tetraconazole intermediate | CHENGDU ABLEXIENUO CHEMICAL TECHNOLOGY Co.,Ltd. (CN) | 2015-10-28 | — | — | CN | claimed |
| CN-102993013-B | Synthesis method of tetraconazole intermediate | CHENGDU ABLEXIENUO CHEMICAL TECHNOLOGY CO LTD | 2015-03-18 | — | — | CN | claimed |
| CN-104016977-A | Substituted thiadiazine diketone derivative as well as preparation method and application thereof | UNIV SHANDONG | 2014-09-03 | — | — | CN | claimed |
| CN-103012296-A | Synthetic method of tetraconazole intermediate | CHENGDU ABLEXIENUO CHEMICAL TECHNOLOGY CO LTD | 2013-04-03 | — | — | CN | claimed |
| CN-102993013-A | Synthesis method of tetraconazole intermediate | CHENGDU ABLEXIENUO CHEMICAL TECHNOLOGY CO LTD | 2013-03-27 | — | — | CN | claimed |
| CN-107047316-B | A kind of iris tissue culture method and culture medium | 郑州市农林科学研究所 | 2019-05-24 | — | — | CN | disclosed |
| CN-105566219-B | The manufacturing method and its manufacture intermediate of 3,4- dihydroisoquinoline derivatives | 三井化学AGRO株式会社 | 2019-03-01 | — | — | CN | disclosed |
| CN-109053410-A | It is a kind of synthesize 1- hydroxy-cyclohexyl formic acid new process and application | 兰博尔开封科技有限公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-108863774-A | A kind of 2,4 dichloro benzene chloroacetic chloride synthetic method | 石家庄市绿丰化工有限公司 | 2018-11-23 | — | — | CN | disclosed |
| CN-105439951-B | The manufacturing method of the manufacture intermediate of 3,4- dihydroisoquinoline derivatives | 三井化学AGRO株式会社 | 2018-07-06 | — | — | CN | disclosed |
| CN-105384871-B | Fluorine-containing hyper branched polymer and the resin combination comprising the polymer | 日产化学工业株式会社 | 2018-03-09 | — | — | CN | disclosed |
| CN-1242007-A | Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising such compounds, and methods of inhibiting beta amyloid peptide release and/or its synthesis using such compounds | ELAND PHARMACEUTICAL CORP (US) | 2000-01-19 | — | — | CN | disclosed |
| CN-1238779-A | Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis | ELAN PHARM INC (US) | 1999-12-15 | — | — | CN | disclosed |
| US-5807875-A | OBESITY THERAPY | DR. KARL THOMAE GMBH (DE) | 1998-09-15 | — | — | US | disclosed |
| CN-1186519-A | Modification of vegetable lipids and seed oils using yeast SLC genes | NAT RESEARCH COUNCIL OF CANDA (CA) | 1998-07-01 | — | — | CN | disclosed |
| CN-1180348-A | Pyrrolidinyl hydroxamic acid compounds and their production process | PFIZER (US) | 1998-04-29 | — | — | CN | disclosed |
| US-5616620-A | HYPOTENSIVE AGENTS | KARL THOMAE GMBH (DE) | 1997-04-01 | — | — | US | disclosed |