Pyrene

Pyrene

SCHEMBL6033008

CC(=O)O.c1cc2ccc3cccc4ccc(c1)c2c34

nearest known ligand 0.61

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Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Pyrene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.61
HSD17B10 Q99714 8/20 0.61
HPGD P15428 7/20 0.61
TSHR P16473 5/20 0.61
CYP1A2 P05177 5/20 0.61
CYP3A4 P08684 3/20 0.61
CYP1A1 P04798 1/20 0.61
CYP1B1 Q16678 1/20 0.61
KMT2A Q03164 6/20 0.60
MEN1 O00255 5/20 0.60
KDM4E B2RXH2 7/20 0.53
MAPT P10636 3/20 0.53
TDP1 Q9NUW8 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 3/20 0.46
CYP2D6 P10635 2/20 0.46
GLA P06280 1/20 0.46
RXFP1 Q9HBX9 1/20 0.44
THRB P10828 1/20 0.42
PPARG P37231 1/20 0.41

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.

Compoundsimilaritytop predictedshared targets
Pyrene SCHEMBL15110211 0.92 ALDH1A1 (0.65) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL21599111 0.88 ALDH1A1 (0.69) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL27945310 0.86 ALDH1A1 (0.58) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL27931631 0.86 ALDH1A1 (0.58) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL17023864 0.85 KMT2A (0.52) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Acetic Acid SCHEMBL27954037 0.85 FFAR3 (0.47) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Acetic Acid SCHEMBL27656922 0.85 FFAR3 (0.47) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Acetic Acid SCHEMBL29538855 0.84 ALDH1A1 (0.50) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Acetic Acid SCHEMBL28706282 0.84 ALDH1A1 (0.50) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Acetic Acid SCHEMBL28736368 0.84 ALDH1A1 (0.50) ALDH1A1HSD17B10HPGDTSHRCYP1A2

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113889577-B Flexible field effect sensor and method for preparing same based on ultraviolet lithography 中国农业科学院北京畜牧兽医研究所 2022-09-23 CN claimed
CN-113889577-A Flexible field effect sensor and method for preparing same based on ultraviolet lithography 中国农业科学院北京畜牧兽医研究所 2022-01-04 CN claimed
CN-108148001-A Aryl imidazoles, preparation method and its dark blue photoelectricity electroluminescence device of hexyl substitution-fluorenes modification 广东工业大学 2018-06-12 CN claimed
CN-106146829-B A kind of polymer containing two or more pyrenyl groups and its production and use 烟台大学 2018-01-30 CN claimed
CN-106146829-A A kind of polymer containing two or more pyrenyl groups and its production and use 烟台大学 2016-11-23 CN claimed
US-8778501-B2 Fluorescent polymers for oxygen sensing HONEYWELL INTERNATIONAL INC. (US) 2014-07-15 US claimed
CN-103450714-A Conductive graphite flake and preparation method thereof TORAY ADVANCED MATERIALS RES LAB CHINA CO LTD 2013-12-18 CN claimed
EP-2461155-B1 Fluorescent polymers for oxygen sensing HONEYWELL INT INC (US) 2012-10-17 EP claimed
US-20120141807-A1 FLUORESCENT POLYMERS FOR OXYGEN SENSING HONEYWELL INTERNATIONAL INC. (US) 2012-06-07 US claimed
EP-2461155-A1 Fluorescent polymers for oxygen sensing Honeywell International Inc. (US) 2012-06-06 EP claimed
CN-119346074-A Pyrenyl beta-cyclodextrin magnetic graphene oxide gel, preparation method thereof and application thereof in food safety detection 中国检验检疫科学研究院 2025-01-24 CN disclosed
US-20230273193-A1 SENSOR DEVICE, REAGENT FOR MODIFYING SURFACE OF SENSOR ELEMENT, METHOD OF MODIFYING SURFACE OF SENSOR ELEMENT AND METHOD OF MANUFACTURING SENSOR DEVICE KABUSHIKI KAISHA TOSHIBA (JP) 2023-08-31 US disclosed
CN-109270130-B Systems and methods for analyte sensing in a physiological gas sample 明尼苏达大学董事会 2023-08-29 CN disclosed
CN-116272697-A Preparation method of hydrophobic molecular water-phase dispersion liquid 上海慧翌新材料科技有限公司 2023-06-23 CN disclosed
CN-113501860-B Assembled nano liquid metal particles and preparation method and application thereof 国家纳米科学中心 2023-06-16 CN disclosed
CN-1724597-A Phase change inks XEROX CORP (US) 2006-01-25 CN disclosed
CN-1479870-A Optical detection of glucose using boronic acid adducts ���������Ǵ�ѧ���»� 2004-03-03 CN disclosed
CN-1381713-A Sensor for investigating metallorganic compound DINASOERASTOUMIS S A (ES) 2002-11-27 CN disclosed
CN-1301264-A Pyrrolidine-3-carboxylic acid derivatives and their use as endothelin antagonists ABBOTT LAB (US) 2001-06-27 CN disclosed
US-5466578-A Cationic surfactants and labels of fluorescent compounds containing pyrene, naphthalene or anthracene with phosphate groups THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1995-11-14 US disclosed