Baicalein

Baicalein

SCHEMBL2420136

O.O=c1cc(-c2ccccc2)oc2cc(O)c(O)c(O)c12

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Baicalein. 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
MEN1 known ✓ O00255 3/20 0.97
HDAC8 known ✓ Q9BY41 2/20 0.97
HDAC6 known ✓ Q9UBN7 2/20 0.97
THRB known ✓ P10828 1/20 0.97
HDAC1 known ✓ Q13547 1/20 0.97
FLT3 known ✓ P36888 1/20 0.69
PTGS2 known ✓ P35354 1/20 0.67
GSK3A known ✓ P49840 1/20 0.67
GSK3B known ✓ P49841 1/20 0.67
ABCB1 P08183 6/20 0.97
PTPRS Q13332 6/20 0.97
CREB1 P16220 6/20 0.97
CYP1A1 P04798 4/20 0.97
KMT2A Q03164 4/20 0.97
CYP1B1 Q16678 4/20 0.97
FTO Q9C0B1 4/20 0.97
GABRP O00591 3/20 0.97
GABRD O14764 3/20 0.97
GABRA1 P14867 3/20 0.97
GABRB1 P18505 3/20 0.97

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
Baicalein SCHEMBL139617 0.98 ABCB1 (1.00) ABCB1PTPRSCREB1CYP1A1KMT2A
Baicalein SCHEMBL29385549 0.98 ABCB1 (1.00) ABCB1PTPRSCREB1CYP1A1KMT2A
Baicalein SCHEMBL5695785 0.98 ABCB1 (1.00) ABCB1PTPRSCREB1CYP1A1KMT2A
Baicalein SCHEMBL28630648 0.97 ABCB1 (0.97) ABCB1PTPRSCREB1CYP1A1KMT2A
Baicalein SCHEMBL28198926 0.97 ABCB1 (0.97) ABCB1PTPRSCREB1CYP1A1KMT2A
Baicalein SCHEMBL28372093 0.97 ABCB1 (0.97) ABCB1PTPRSCREB1CYP1A1KMT2A
Baicalein SCHEMBL28087999 0.97 ABCB1 (0.97) ABCB1PTPRSCREB1CYP1A1KMT2A
Baicalein SCHEMBL28826034 0.97 ABCB1 (0.97) ABCB1PTPRSCREB1CYP1A1KMT2A
Baicalein SCHEMBL28206740 0.97 ABCB1 (0.97) ABCB1PTPRSCREB1CYP1A1KMT2A
SCHEMBL8250407 0.95 ABCB1 (0.94) ABCB1PTPRSCREB1CYP1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114306631-B Composite nano particle based on rice protein zymolyte and preparation method and application thereof 齐鲁工业大学 2024-07-16 CN claimed
CN-114105930-A Short rod-shaped MPN material based on coordination of baicalein and copper ions and preparation method and application thereof 中国医学科学院基础医学研究所 2022-03-01 CN claimed
US-8673983-B2 Melanins synthesized chemically or via enzyme catalysis LOYOLA UNIVERSITY CHICAGO (US) 2014-03-18 US claimed
US-20110230562-A1 MELANINS SYNTHESIZED CHEMICALLY OR VIA ENZYME CATALYSIS LOYOLA UNIVERSITY CHICAGO 2011-09-22 US claimed
US-7365099-B2 Reducing lipoxygenase activity by administering enzyme inhibitor WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-04-29 US claimed
US-20020197301-A1 Animal body fat control WISCONSIN ALUMNI RESEARCH FOUNDATION 2002-12-26 US claimed
CN-118754865-B Baicalein derivative, preparation method thereof and application of baicalein derivative as pancreatic lipase inhibitor 浙江析木生物科技有限公司 2025-06-17 CN disclosed
CN-118754865-A Baicalein derivative, preparation method thereof and application of baicalein derivative as pancreatic lipase inhibitor 浙江析木生物科技有限公司 2024-10-11 CN disclosed
CN-114105930-B Short rod-shaped MPN material based on coordination of baicalein and copper ions, and preparation method and application thereof 中国医学科学院基础医学研究所 2024-05-10 CN disclosed
CN-114105930-B Short rod-shaped MPN material based on coordination of baicalein and copper ions, and preparation method and application thereof 中国医学科学院基础医学研究所 2024-05-10 CN disclosed
CN-114105930-A Short rod-shaped MPN material based on coordination of baicalein and copper ions and preparation method and application thereof 中国医学科学院基础医学研究所 2022-03-01 CN disclosed
CN-114105930-A Short rod-shaped MPN material based on coordination of baicalein and copper ions and preparation method and application thereof 中国医学科学院基础医学研究所 2022-03-01 CN disclosed
CN-113304265-A Hyaluronic acid baicalein iron nanoparticles and preparation method thereof 重庆医科大学 2021-08-27 CN disclosed
US-20110230562-A1 MELANINS SYNTHESIZED CHEMICALLY OR VIA ENZYME CATALYSIS LOYOLA UNIVERSITY CHICAGO 2011-09-22 US disclosed
US-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
WO-2009082735-A1 MELANINS SYNTHESIZED CHEMICALLY OR VIA ENZYME CATALYSIS UNIVERSITY OF CHICAGO (US) 2009-07-02 WO disclosed
US-7365099-B2 Reducing lipoxygenase activity by administering enzyme inhibitor WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-04-29 US disclosed
US-20040146539-A1 Topical Nutraceutical Compositions with Selective Body Slimming and Tone Firming Antiaging Benefits GUPTA SHYAM K (US) 2004-07-29 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed
US-20020197301-A1 Animal body fat control WISCONSIN ALUMNI RESEARCH FOUNDATION 2002-12-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110230562-A1 MELANINS SYNTHESIZED CHEMICALLY OR VIA ENZYME CATALYSIS TYR, TH, MAOA MEN1 1492/4885HDAC8 3458/4885HDAC6 2346/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.