Metomidate

Metomidate

SCHEMBL1845324

COC(=O)c1cncn1C(C)c1ccccc1.Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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 Metomidate. 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
GABRA1 known ✓ P14867 7/20 0.72
GABRB2 known ✓ P47870 6/20 0.72
GABRA2 known ✓ P47869 1/20 0.72
MAPK1 P28482 1/20 1.00
CYP11B1 P15538 3/20 0.72
CYP11B2 P19099 3/20 0.72
CYP1A2 P05177 2/20 0.72
CYP3A4 P08684 2/20 0.72
LMNA P02545 1/20 0.72
CYP2C9 P11712 1/20 0.72
CYP2C19 P33261 1/20 0.72
ABCB11 O95342 1/20 0.72
ALDH1A1 P00352 1/20 0.72
TDP1 Q9NUW8 1/20 0.72
SMN1; SMN2 Q16637 1/20 0.57
GPBAR1 Q8TDU6 4/20 0.55
MAPT P10636 1/20 0.43
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39

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
Metomidate SCHEMBL4377172 0.99 MAPK1 (0.97) MAPK1GABRA1GABRB2CYP11B1CYP11B2
Metomidate SCHEMBL491910 0.99 MAPK1 (0.97) MAPK1GABRA1GABRB2CYP11B1CYP11B2
Metomidate SCHEMBL11733503 0.93 MAPK1 (0.88) MAPK1GABRA1GABRB2CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL11334431 0.87 MAPK1 (0.78) MAPK1GABRA1GABRB2CYP11B1CYP11B2
SCHEMBL19062800 0.86 MAPK1 (0.76) MAPK1GABRA1GABRB2CYP11B1CYP11B2
SCHEMBL15125287 0.86 MAPK1 (0.76) MAPK1GABRA1GABRB2CYP11B1CYP11B2
SCHEMBL15125277 0.86 MAPK1 (0.76) MAPK1GABRA1GABRB2CYP11B1CYP11B2
SCHEMBL22004285 0.86 MAPK1 (0.76) MAPK1GABRA1GABRB2CYP11B1CYP11B2
SCHEMBL31406537 0.86 MAPK1 (0.76) MAPK1GABRA1GABRB2CYP11B1CYP11B2
SCHEMBL18265957 0.86 MAPK1 (0.75) MAPK1GABRA1GABRB2CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4460178-A1 METHOD TO DETACH ECTOPARASITES FROM FISH Intervet International B.V. (NL) 2024-11-13 EP disclosed
WO-2023131615-A1 METHOD TO DETACH ECTOPARASITES FROM FISH INTERVET INTERNATIONAL B.V. (NL) 2023-07-13 WO disclosed
US-20230001128-A1 AEROSOLIZATION SYSTEMS, METHODS, AND APPARATUSES SHUSTER GARY STEPHEN (CA) 2023-01-05 US disclosed
EP-3424536-B1 ANAESTHETIC SOLUTION AND METHOD OF USE THEREOF FOR ANAESTHETISING, STUNNING AND SLAUGHTERING FISH UNIV CARTAGENA POLITECNICA (ES) 2021-01-27 EP disclosed
EP-3424536-A1 ANAESTHETIC SOLUTION AND METHOD OF USE THEREOF FOR ANAESTHETISING, STUNNING AND SLAUGHTERING FISH Universidad Politecnica de Cartagena (ES) 2019-01-09 EP disclosed
US-8865197-B2 Food formulation for aquatic animals with integrated targeted delivery of bioactive agents ISRAEL OCEANOGRAPHIC AND LIMNOLOGICAL RESEARCH LTD. (IL) 2014-10-21 US disclosed
EP-1941872-B1 Use of TNF-alpha inhibitors for treating nerve root injury SCIATICON AB (SE) 2013-04-10 EP disclosed
US-20120244157-A1 USE OF TNF-ALPHA INHIBITORS FOR TREATING A NERVE DISORDER MEDIATED BY NUCLEUS PULPOSUS SCIATICON AB (SE) 2012-09-27 US disclosed
EP-2324843-A1 Use of TNF-alpha inhibitors for treating nerve root injury Sciaticon AB (SE) 2011-05-25 EP disclosed
US-20100305048-A1 NOVEL USE OF CYTOKINE INHIBITORS PHARMASURGICS IN SWEDEN AB (SE) 2010-12-02 US disclosed
US-20010055594-A1 Use of certain drugs for treating nerve root injury SCIATICON AB (SE) 2001-12-27 US disclosed
US-20010027175-A1 Use of certain drugs for treating nerve root injury A + SCIENCE AB (PUBL) (SE) 2001-10-04 US disclosed
US-20010027199-A1 Use of certain drugs for treating nerve root injury SCIATICON AB (SE) 2001-10-04 US disclosed
EP-1115405-A1 USE OF CERTAIN DRUGS FOR TREATING NERVE ROOT INJURY A+ Science Invest AB (SE) 2001-07-18 EP disclosed
WO-2000075659-A1 ANTIBODIES TO NUCLEUS PULPOSUS IN DISC HERNIATION, DIAGNOSTIC KIT, MEDICAL PREPARATIONS AND TREATMENT A+SCIENCE INVEST AB (SE) 2000-12-14 WO disclosed
WO-2000018409-A1 USE OF CERTAIN DRUGS FOR TREATING NERVE ROOT INJURY A+ SCIENCE INVEST AB (SE) 2000-04-06 WO disclosed
US-5639457-A INTRODUCING DNA SEQUENCE CODING FOR REARRANGED ANTIBODY INTO MALE PRONUCLEUS OF FERTILIZED OVUM; IMPLANTING IN PIG OR RABBIT; TRANSGENIC OFFSPRING PRODUCE ANTIBODIES Brem, Gottfried (DE) 1997-06-17 US disclosed
US-5221734-A Separation by chromatography CIBA-GEIGY CORPORATION (US) 1993-06-22 US disclosed
EP-0313515-B1 A POLYPEPTIDE GROWTH FACTOR FROM MILK CIBA-GEIGY AG (CH) 1992-03-11 EP disclosed
EP-0313515-A1 A polypeptide growth factor from milk CIBA-GEIGY AG (CH) 1989-04-26 EP disclosed