Lauroguadine

Lauroguadine

SCHEMBL21494449

CCCCCCCCCCCCOc1ccc(N=C(N)N)cc1N=C(N)N.Cl.Cl

nearest known ligand 0.97

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 Lauroguadine. 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
JAK2 known ✓ O60674 1/20 0.97
ROCK2 known ✓ O75116 1/20 0.97
PRKCG known ✓ P05129 1/20 0.97
PRKCZ known ✓ Q05513 1/20 0.97
PRKCD known ✓ Q05655 1/20 0.97
ROCK1 known ✓ Q13464 1/20 0.97
ERBB4 known ✓ Q15303 1/20 0.97
NTRK2 known ✓ Q16620 1/20 0.97
HTR3E known ✓ A5X5Y0 1/20 0.50
HTR3B known ✓ O95264 1/20 0.50
HTR3A known ✓ P46098 1/20 0.50
HTR3D known ✓ Q70Z44 1/20 0.50
HTR3C known ✓ Q8WXA8 1/20 0.50
ADRA2A known ✓ P08913 3/20 0.44
CHRM2 known ✓ P08172 1/20 0.43
OPRK1 known ✓ P41145 1/20 0.43
HTR2B known ✓ P41595 1/20 0.43
SLC6A3 known ✓ Q01959 1/20 0.43
HDAC6 known ✓ Q9UBN7 1/20 0.43
CHUK O15111 1/20 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
Lauroguadine SCHEMBL1651264 0.99 CHUK (1.00) CHUKDAPK3JAK2ROCK2PRKCG
Lauroguadine SCHEMBL28331072 0.96 CHUK (0.95) CHUKDAPK3JAK2ROCK2PRKCG
Hydrochloric Acid SCHEMBL28332581 0.77 CHUK (0.60) CHUKDAPK3JAK2ROCK2PRKCG
SCHEMBL27663840 0.74 FURIN (0.77) CHUKDAPK3JAK2ROCK2PRKCG
SCHEMBL5243029 0.68 HTR3E (1.00) CHUKDAPK3JAK2ROCK2PRKCG
SCHEMBL8611330 0.68 SMPD1 (0.57) CHUKDAPK3JAK2ROCK2PRKCG
SCHEMBL22521646 0.68 SMPD1 (0.57) CHUKDAPK3JAK2ROCK2PRKCG
SCHEMBL16201871 0.67 CHUK (0.51) CHUKDAPK3JAK2ROCK2PRKCG
SCHEMBL29510772 0.67 CHUK (0.51) CHUKDAPK3JAK2ROCK2PRKCG
SCHEMBL908852 0.67 CHUK (0.51) CHUKDAPK3JAK2ROCK2PRKCG

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110386988-B Modified starch and preparation method and application thereof 瑞辰星生物技术(广州)有限公司 2021-06-04 CN disclosed
CN-110387761-B Method for recovering free starch in papermaking white water 瑞辰星生物技术(广州)有限公司 2021-02-19 CN disclosed
CN-110387765-B Method for making paper 瑞辰星生物技术(广州)有限公司 2021-01-01 CN disclosed
WO-2019201221-A1 MODIFIED STARCH AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 瑞辰星生物技术(广州)有限公司 2019-10-24 WO disclosed