Cefetamet

Cefetamet

SCHEMBL11211852

CO/N=C(\C(=O)NC1C(=O)N2C(C(=O)O)=C(C)CS[C@H]12)c1csc(N)n1.Cl

nearest known ligand 0.78

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 Cefetamet. 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
▸ HTR2C known ✓ P28335 1/20 0.78
▸ PPARG known ✓ P37231 2/20 0.75
▸ PTGS1 known ✓ P23219 1/20 0.73
▸ PTGS2 known ✓ P35354 1/20 0.71
▸ ESR1 known ✓ P03372 1/20 0.64
▸ DRD2 known ✓ P14416 1/20 0.64
▸ ADRA2B known ✓ P18089 1/20 0.64
▸ HRH3 known ✓ Q9Y5N1 1/20 0.64
▸ NR1I2 O75469 6/20 0.78
▸ MAPT P10636 3/20 0.75
▸ SLC22A6 Q4U2R8 2/20 0.75
▸ SLC22A8 Q8TCC7 2/20 0.75
▸ SLC22A11 Q9NSA0 2/20 0.75
▸ ALB P02768 1/20 0.75
▸ PGR P06401 3/20 0.71
▸ TDP1 Q9NUW8 6/20 0.66
▸ APEX1 P27695 3/20 0.66
▸ LMNA P02545 2/20 0.66
▸ L3MBTL1 Q9Y468 2/20 0.66
▸ APAF1 O14727 2/20 0.66

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
Cefetamet SCHEMBL2586142 1.00 NR1I2 (0.78) NR1I2HTR2CMAPTPPARGSLC22A6
Cefetamet SCHEMBL2586134 1.00 NR1I2 (0.78) NR1I2HTR2CMAPTPPARGSLC22A6
Cefetamet SCHEMBL11211861 1.00 NR1I2 (0.78) NR1I2HTR2CMAPTPPARGSLC22A6
Cefetamet SCHEMBL27791862 0.99 NR1I2 (0.77) NR1I2HTR2CMAPTPPARGSLC22A6
Cefetamet SCHEMBL65620 0.99 NR1I2 (0.79) NR1I2HTR2CMAPTPPARGSLC22A6
Cefetamet SCHEMBL9367206 0.99 NR1I2 (0.79) NR1I2HTR2CMAPTPPARGSLC22A6
Cefetamet SCHEMBL7863727 0.99 NR1I2 (0.79) NR1I2HTR2CMAPTPPARGSLC22A6
Cefetamet SCHEMBL10587831 0.99 NR1I2 (0.79) NR1I2HTR2CMAPTPPARGSLC22A6
Cefetamet SCHEMBL10587826 0.99 NR1I2 (0.79) NR1I2HTR2CMAPTPPARGSLC22A6
Cefetamet SCHEMBL151099 0.99 NR1I2 (0.79) NR1I2HTR2CMAPTPPARGSLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4400503-A FORMATION OF HYDROCHLORIDE SALT ELI LILLY AND COMPANY (US) 1983-08-23 — — US disclosed
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