Atropine Oxide

Atropine Oxide

SCHEMBL667605

C[N+]1([O-])C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2.Cl

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Atropine Oxide. 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
CHRM2 known ✓ P08172 6/20 0.80
CHRM5 known ✓ P08912 5/20 0.75
CHRM1 known ✓ P11229 5/20 0.75
CHRM3 known ✓ P20309 5/20 0.75
CHRM4 known ✓ P08173 4/20 0.75
ADRA2C known ✓ P18825 1/20 0.63
HTR2C known ✓ P28335 1/20 0.63
ADRA1A known ✓ P35348 1/20 0.63
HRH1 known ✓ P35367 1/20 0.63
CYP2C19 P33261 1/20 0.98
BLM P54132 4/20 0.78
PABPC1 P11940 1/20 0.78
SMN1; SMN2 Q16637 2/20 0.76
MEN1 O00255 3/20 0.75
KMT2A Q03164 3/20 0.75
TSHR P16473 2/20 0.75
CYP3A4 P08684 1/20 0.65
CYP2C9 P11712 1/20 0.65
HIF1A Q16665 1/20 0.65
HSD17B10 Q99714 1/20 0.65

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
Atropine Oxide SCHEMBL1490299 0.99 CYP2C19 (0.95) CYP2C19CHRM2BLMPABPC1SMN1; SMN2
Atropine Oxide SCHEMBL1490302 0.99 CYP2C19 (0.95) CYP2C19CHRM2BLMPABPC1SMN1; SMN2
Atropine Oxide SCHEMBL162929 0.99 CYP2C19 (1.00) CYP2C19CHRM2BLMPABPC1SMN1; SMN2
Atropine Oxide SCHEMBL29369999 0.99 CYP2C19 (1.00) CYP2C19CHRM2BLMPABPC1SMN1; SMN2
Atropine Oxide SCHEMBL98985 0.99 CYP2C19 (1.00) CYP2C19CHRM2BLMPABPC1SMN1; SMN2
Methylatropine SCHEMBL34463463 0.89 CHRM2 (1.00) CYP2C19CHRM2BLMPABPC1SMN1; SMN2
Methylatropine SCHEMBL824874 0.89 CHRM2 (1.00) CYP2C19CHRM2BLMPABPC1SMN1; SMN2
Methylatropine SCHEMBL1321572 0.88 BLM (1.00) CYP2C19CHRM2BLMPABPC1SMN1; SMN2
Methylatropine SCHEMBL30647266 0.88 BLM (1.00) CYP2C19CHRM2BLMPABPC1SMN1; SMN2
Methylatropine SCHEMBL29389879 0.88 PABPC1 (1.00) CYP2C19CHRM2BLMPABPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240335378-A1 COMPOSITIONS AND METHODS FOR TREATING SIALORRHEA UNIV UTAH RES FOUND (US) 2024-10-10 US claimed
US-20240335378-A1 COMPOSITIONS AND METHODS FOR TREATING SIALORRHEA UNIV UTAH RES FOUND (US) 2024-10-10 US disclosed
EP-4426302-A1 COMPOSITIONS AND METHODS FOR TREATING SIALORRHEA University of Utah Research Foundation (US) 2024-09-11 EP disclosed
US-12048763-B2 Compositions and methods for treating sialorrhea UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2024-07-30 US disclosed
US-20230149306-A1 COMPOSITIONS AND METHODS FOR TREATING SIALORRHEA UNIVERSITY OF UTAH RESEARCH FOUNDATION 2023-05-18 US disclosed
WO-2023076698-A1 COMPOSITIONS AND METHODS FOR TREATING SIALORRHEA UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2023-05-04 WO disclosed
WO-2022211996-A1 LIPOPHILIC ACTIVE AGENT INFUSED TOBACCO LEAVES AND/OR TOBACCO MATERIALS AND METHODS OF USE THEREOF Poviva Corp. (US) 2022-10-06 WO disclosed
US-20210289832-A1 LIPOPHILIC ACTIVE AGENT INFUSED TOBACCO LEAVES AND/OR TOBACCO MATERIALS AND METHODS OF USE THEREOF Poviva Corp. (US) 2021-09-23 US disclosed
US-20210290771-A1 ENGINEERED RECEPTOR/LIGAND SYSTEM FOR DELIVERY OF THERAPEUTIC AGENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2021-09-23 US disclosed
EP-3849347-A1 LIPOPHILIC ACTIVE AGENT INFUSED TOBACCO LEAVES AND/OR TOBACCO MATERIALS AND METHODS OF USE THEREOF Poviva Corp. (US) 2021-07-21 EP disclosed
EP-1163011-A2 FATTY ACID-ANTICANCER CONJUGATES AND USES THEREOF Protarga Inc. (US) 2001-12-19 EP disclosed
US-6267957-B1 Attaching agents to tissue with transglutaminase and a transglutaminase substrate PERICOR SCIENCE, INC. 2001-07-31 US disclosed
US-20010002404-A1 Fatty acid-pharmaceutical agent conjugates LUITPOLD PHARMACEUTICALS, INC. 2001-05-31 US disclosed
WO-2001007009-A1 LYSINE OXIDASE LINKAGE OF AGENTS TO TISSUE PERICOR SCIENCE, INC. (US) 2001-02-01 WO disclosed
WO-2001006829-A2 LINKAGE OF AGENTS TO TISSUE PERICOR SCIENCE, INC. (US) 2001-02-01 WO disclosed
EP-1054998-A1 TRANSGLUTAMINASE LINKAGE OF AGENTS TO TISSUE Pericor Science, Inc. (US) 2000-11-29 EP disclosed
WO-2000053231-A2 FATTY ACID-ANTICANCER CONJUGATES AND USES THEREOF PROTARGA, INC. (US) 2000-09-14 WO disclosed
WO-1999036570-A2 TRANSGLUTAMINASE LINKAGE OF AGENTS TO TISSUE PERICOR SCIENCE INC (US) 1999-07-22 WO disclosed
WO-1999030690-A1 ORAL DELIVERY FORMULATION AXIA THERAPEUTICS, INC. (US) 1999-06-24 WO disclosed
US-5795909-A ANTICARCINOGENIC AND ANTITUMOR AGENTS; BREAST, COLON, OVARIANCANCERS NEUROMEDICA, INC. (US) 1998-08-18 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 (4 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-20010002404-A1 Fatty acid-pharmaceutical agent conjugates FABP7, FFAR2, FFAR4 CHRM2 2104/4885CHRM5 1909/4885CHRM1 3136/4885
US-20240335378-A1 COMPOSITIONS AND METHODS FOR TREATING SIALORRHEA ACHE, MUC1, NEU3 CHRM2 24/4885CHRM5 30/4885CHRM1 134/4885
US-20230149306-A1 COMPOSITIONS AND METHODS FOR TREATING SIALORRHEA ACHE, MUC1, NEU3 CHRM2 24/4885CHRM5 30/4885CHRM1 134/4885
US-12048763-B2 Compositions and methods for treating sialorrhea ACHE, NEU3, AMY2A CHRM2 14/4885CHRM5 19/4885CHRM1 127/4885

“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.