Terbinafine

Terbinafine

SCHEMBL29066152

CN(C/C=C/C#CC(C)(C)C)Cc1cccc2ccccc12.Cl.O

nearest known ligand 0.95

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 Terbinafine. 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
SLC6A2 known ✓ P23975 3/20 0.95
SIGMAR1 known ✓ Q99720 3/20 0.95
ADRA2A known ✓ P08913 2/20 0.95
HTR2A known ✓ P28223 2/20 0.60
SLC6A4 known ✓ P31645 2/20 0.60
KCNH2 known ✓ Q12809 2/20 0.60
DRD2 known ✓ P14416 1/20 0.60
ADRA2C known ✓ P18825 1/20 0.60
ADRA1A known ✓ P35348 1/20 0.60
OPRK1 known ✓ P41145 1/20 0.60
SLC6A3 known ✓ Q01959 1/20 0.60
ACHE known ✓ P22303 1/20 0.47
CYP2D6 P10635 4/20 0.95
LMNA P02545 4/20 0.95
SQLE Q14534 2/20 0.95
ATM Q13315 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
CYP1A2 P05177 2/20 0.60
CYP2C19 P33261 2/20 0.60
NR1I2 O75469 2/20 0.60

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
Terbinafine SCHEMBL36793 0.99 CYP2D6 (0.97) CYP2D6LMNASLC6A2SIGMAR1ADRA2A
Terbinafine SCHEMBL29871278 0.99 CYP2D6 (0.97) CYP2D6LMNASLC6A2SIGMAR1ADRA2A
Terbinafine SCHEMBL29365335 0.99 CYP2D6 (0.97) CYP2D6LMNASLC6A2SIGMAR1ADRA2A
Terbinafine SCHEMBL29216417 0.99 CYP2D6 (0.97) CYP2D6LMNASLC6A2SIGMAR1ADRA2A
Terbinafine SCHEMBL36795 0.99 CYP2D6 (0.97) CYP2D6LMNASLC6A2SIGMAR1ADRA2A
Terbinafine SCHEMBL5279646 0.97 CYP2D6 (1.00) CYP2D6LMNASLC6A2SIGMAR1ADRA2A
Terbinafine SCHEMBL37843 0.97 CYP2D6 (1.00) CYP2D6LMNASLC6A2SIGMAR1ADRA2A
Terbinafine SCHEMBL36794 0.97 CYP2D6 (1.00) CYP2D6LMNASLC6A2SIGMAR1ADRA2A
Terbinafine SCHEMBL2028187 0.97 CYP2D6 (1.00) CYP2D6LMNASLC6A2SIGMAR1ADRA2A
Terbinafine SCHEMBL2042785 0.97 CYP2D6 (1.00) CYP2D6LMNASLC6A2SIGMAR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112137979-B Teposinib tablet and preparation method thereof 瑞阳制药股份有限公司 2023-08-25 CN claimed
CN-112137979-B Teposinib tablet and preparation method thereof 瑞阳制药股份有限公司 2023-08-25 CN disclosed