Cysteine

Cysteine

SCHEMBL5063585

Cl.NC(CS)C(=O)[O-].[Na+]

nearest known ligand 0.00

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Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Cysteine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Cysteine SCHEMBL5063587 1.00
Cysteine SCHEMBL6570272 0.97
Cysteine SCHEMBL28776326 0.97
Cysteine SCHEMBL3425155 0.97
Cysteine SCHEMBL8501902 0.97 PTGS1 (0.55)
Cysteine SCHEMBL30808400 0.95
Cysteine SCHEMBL10935445 0.95 PTGS1 (0.52)
Cysteine SCHEMBL23903319 0.92 PTGS1 (0.55)
Cysteine SCHEMBL16194528 0.92
Cysteine SCHEMBL1072972 0.92 PTGS1 (0.55)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0065395-B1 IMPROVED CHYMOPAPAIN AND METHOD FOR ITS PRODUCTION AND USE BOOTS-FLINT, INC. (a Delaware corp.) (US) 1988-08-24 EP claimed
US-4439423-A TREATING INTERVERTEBRAL SPINAL DISCS SMITH LABORATORIES, INC. (US) 1984-03-27 US claimed
EP-0065395-A2 Improved chymopapain and method for its production and use BOOTS-FLINT, INC. (a Delaware corp.) (US) 1982-11-24 EP claimed
US-20080107705-A1 Chymopapain Isoenzymes, Compositions, and Uses Thereof SPINAL THERAPIES LLC (US) 2008-05-08 US disclosed
WO-2006017456-A2 CHYMOPAPAIN ISOENZYMES, COMPOSITIONS, AND USES THEREOF MCDERMOTT DANIEL J (US) 2006-02-16 WO disclosed
US-5468480-A Active against N-A-benzoyl-DL-arginine p-nitroanilide THE BOOTS COMPANY PLC (GB) 1995-11-21 US disclosed
US-5380656-A Chymopapain and method of purifying it on an inhibitory dipeptide affinity column THE BOOTS COMPANY PLC (GB) 1995-01-10 US disclosed
EP-0470136-B1 THERAPEUTIC AGENT BOOTS CO PLC (GB) 1994-06-22 EP disclosed
EP-0470136-A1 THERAPEUTIC AGENT. BOOTS CO PLC (GB) 1992-02-12 EP disclosed
WO-1990013561-A1 THERAPEUTIC AGENT THE BOOTS COMPANY PLC (GB) 1990-11-15 WO disclosed
EP-0065395-B1 IMPROVED CHYMOPAPAIN AND METHOD FOR ITS PRODUCTION AND USE BOOTS-FLINT, INC. (a Delaware corp.) (US) 1988-08-24 EP disclosed
US-4719108-A DISSOLVING SPINAL DISCS SMITH LABORATORIES, INC. (US) 1988-01-12 US disclosed
US-4439423-A TREATING INTERVERTEBRAL SPINAL DISCS SMITH LABORATORIES, INC. (US) 1984-03-27 US disclosed
US-4374926-A ION EXCHANGING ON CARBOXYMETHYL-SUBSTITUTED CROSSLINKED AGAROSE, ELUTION, INORGANIC SALT, FREEZE DRYING SMITH LABORATORIES, INC. (US) 1983-02-22 US disclosed
EP-0065395-A2 Improved chymopapain and method for its production and use BOOTS-FLINT, INC. (a Delaware corp.) (US) 1982-11-24 EP disclosed