Aclarubicin

Aclarubicin

SCHEMBL97477

CC[C@@]1(O)C[C@H](O[C@H]2C[C@H](N(C)C)[C@H](O[C@H]3C[C@H](O)[C@H](O[C@H]4CCC(=O)[C@H](C)O4)[C@H](C)O3)[C@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)[C@H]1C(=O)OC.Cl

nearest known ligand 0.99

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 Aclarubicin. 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
PTGS1 known ✓ P23219 4/20 0.99
HTR2B known ✓ P41595 2/20 0.99
HSP90AA1 known ✓ P07900 4/20 0.43
HDAC6 known ✓ Q9UBN7 1/20 0.37
TOP2A known ✓ P11388 3/20 0.37
HSP90AB1 known ✓ P08238 2/20 0.37
CHRM1 known ✓ P11229 2/20 0.36
ADRA1A known ✓ P35348 2/20 0.36
ESR1 known ✓ P03372 1/20 0.36
NR3C1 known ✓ P04150 1/20 0.36
ERBB2 known ✓ P04626 1/20 0.36
LCK known ✓ P06239 1/20 0.36
ADRA2A known ✓ P08913 1/20 0.36
TOP1 known ✓ P11387 1/20 0.36
HTR2A known ✓ P28223 1/20 0.36
PTGS2 known ✓ P35354 1/20 0.36
TOP2B known ✓ Q02880 1/20 0.36
KCNH2 known ✓ Q12809 1/20 0.36
CHRM2 known ✓ P08172 1/20 0.36
ACHE known ✓ P22303 1/20 0.36

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
Aclarubicin SCHEMBL30077507 1.00 PTGS1 (0.99) PTGS1MMP2HTR2BMEN1KMT2A
Aclarubicin SCHEMBL16767437 1.00 PTGS1 (0.99) PTGS1MMP2HTR2BMEN1KMT2A
Aclarubicin SCHEMBL31238190 1.00 PTGS1 (0.99) PTGS1MMP2HTR2BMEN1KMT2A
Aclarubicin SCHEMBL6255351 0.99 PTGS1 (1.00) PTGS1MMP2HTR2BMEN1KMT2A
Aclarubicin SCHEMBL10201119 0.99 PTGS1 (1.00) PTGS1MMP2HTR2BMEN1KMT2A
Aclarubicin SCHEMBL17035568 0.99 PTGS1 (1.00) PTGS1MMP2HTR2BMEN1KMT2A
Aclarubicin SCHEMBL31277372 0.99 PTGS1 (1.00) PTGS1MMP2HTR2BMEN1KMT2A
Aclarubicin SCHEMBL10061856 0.99 PTGS1 (1.00) PTGS1MMP2HTR2BMEN1KMT2A
Aclarubicin SCHEMBL10079204 0.99 PTGS1 (1.00) PTGS1MMP2HTR2BMEN1KMT2A
Aclarubicin SCHEMBL31238004 0.99 PTGS1 (1.00) PTGS1MMP2HTR2BMEN1KMT2A

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

Appears in 2100 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119679758-A Preparation method and application of graphene oxide microcapsule carrying hydrophilic drug 东北大学 2025-03-25 CN claimed
WO-2022144780-A1 SULFONAMIDE DERIVATIVES, COMPOSITIONS COMPRISING SAME AND USES THEREOF IN THE TREATMENT OF CANCERS NATIONAL CANCER CENTER (JP) 2022-07-07 WO claimed
CN-109806252-B Ternary composite nano system and preparation method and application thereof 中国药科大学 2021-08-10 CN claimed
CN-110354099-B Proton-triggered nano-drug system with hydrophilic-hydrophobic-size double conversion characteristics and preparation method and application thereof 中国药科大学 2021-06-11 CN claimed
CN-112057434-A Mesoporous silicon nano particle capable of responding X-ray medicine release and preparation method and application thereof 华南理工大学 2020-12-11 CN claimed
US-10584317-B2 Modified vaccinia virus strains for use in diagnostic and therapeutic methods GENELUX CORPORATION (US) 2020-03-10 US claimed
CN-110354099-A A kind of Nano medication system and its preparation method and application with the double transfer characteristics of hydrophobe-size based on proton triggering 中国药科大学 2019-10-22 CN claimed
CN-109806252-A Tri compound nanometer system and its preparation method and application 中国药科大学 2019-05-28 CN claimed
CN-106279635-B Class antibacterial peptide and vesica and its preparation method and application 同济大学 2019-01-25 CN claimed
CN-109045347-A A kind of degradable load medicine hemostatic microsphere and preparation method thereof 温州生物材料与工程研究所 2018-12-21 CN claimed
EP-1911449-A1 ANTI-TUMOR AGENT COMPRISING 6'-AMIDINO-2'-NAPHTHYL4- GUANIDINOBENZOATE OR SALT THEREOF TORII PHARMACEUTICAL CO., LTD. (JP) 2008-04-16 EP claimed
CN-101098684-A Composition for preventing and treating radical diseases VITAMIN C60 BIORES CORP (JP) 2008-01-02 CN claimed
EP-1834637-A1 PREVENTIVE/THERAPEUTIC COMPOSITION FOR FREE RADICAL DISEASE Vitamin C60 Bioresearch Corporation (JP) 2007-09-19 EP claimed
US-20020010210-A1 PHARMACEUTICAL PREPARATION AND METHOD FOR TREATING CANCER SHOWA DENKO KABUSHIKI KAISHA (JP) 2002-01-24 US claimed
EP-0875246-A1 Pharmaceutical preparation of ascorbic acid derivatives for medical treatment of cancer SHOWA DENKO KABUSHIKI KAISHA (JP) 1998-11-04 EP claimed
EP-0608546-A2 Glia activating factor (GAF), antibodies against it and their uses TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-08-03 EP claimed
EP-0132105-B1 OILY COMPOSITION OF ACLARUBICIN OR HYDROCHLORIDE THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1990-10-31 EP claimed
US-4772590-A Oily composition of aclarubicin or hydrochloride thereof YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1988-09-20 US claimed
US-4578391-A Oily compositions of antitumor drugs YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-03-25 US claimed
EP-0132105-A2 Oily composition of aclarubicin or hydrochloride thereof YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1985-01-23 EP claimed