Hydrochloric Acid

Hydrochloric Acid

SCHEMBL619755

CC1=C(C)C(C)(C)C([Ti](Oc2ccc(F)cc2-c2ccccc2)C2=C(C)C(C)=C(C)C2(C)C)=C1C.Cl

nearest known ligand 0.33

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 Hydrochloric Acid. 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
HTR2A known ✓ P28223 2/20 0.33
SLC6A4 known ✓ P31645 2/20 0.33
MAOA known ✓ P21397 1/20 0.32
MAOB known ✓ P27338 1/20 0.32
JAK2 known ✓ O60674 1/20 0.31
NR3C1 known ✓ P04150 2/20 0.31
FFAR4 Q5NUL3 2/20 0.33
SYK P43405 1/20 0.33
BACE1 P56817 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
JAK3 P52333 1/20 0.31
CCNE2 O96020 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
SQOR Q9Y6N5 1/20 0.30
PGR P06401 1/20 0.30
NR3C2 P08235 1/20 0.30

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
SCHEMBL3258326 0.99 HTR2A (0.34) HTR2ASLC6A4FFAR4SYKBACE1
SCHEMBL370497 0.76 HTR7 (0.35) SMN1; SMN2HSD17B10L3MBTL1
Hydrochloric Acid SCHEMBL619754 0.75 SYK (0.35) HTR2ASLC6A4FFAR4SYKBACE1
Hydrochloric Acid SCHEMBL3623901 0.73 HSD11B1 (0.37) HSD17B10PGRAR
SCHEMBL3811401 0.73 CCNE2 (0.32) HTR2ASLC6A4SYKBACE1JAK2
SCHEMBL6608193 0.68 SYK (0.52) FFAR4SYKBACE1SMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL27790652 0.67 SYK (0.39) HTR2ASLC6A4FFAR4SYKBACE1
SCHEMBL22186612 0.65 HTR7 (0.37) SMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL8762958 0.65 CA4 (0.30)
Hydrochloric Acid SCHEMBL9311952 0.65 ALDH1A1 (0.52) BACE1HSD17B10L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8674026-B2 Ethylene copolymer having multiple pitch in molecular weight distribution and the method of preparing the same SK INNOVATION CO., LTD. (KR) 2014-03-18 US disclosed
US-8492494-B2 Ethylene copolymer with improved impact resistance SK INNOVATION CO., LTD. (KR) 2013-07-23 US disclosed
US-20130137837-A1 ETHYLENE COPOLYMER WITH IMPROVED IMPACT RESISTANCE SABIC SK NEXLENE COMPANY PTE. LTD. (SG) 2013-05-30 US disclosed
EP-2185611-B1 ETHYLENE COPOLYMER HAVING MULTIPLE PITCH IN MOLECULAR WEIGHT DISTRIBUTION AND THE METHOD OF PREPARING THE SAME SK INNOVATION CO LTD (KR) 2013-03-27 EP disclosed
EP-2365990-B1 ETHYLENE COPOLYMER WITH IMPROVED IMPACT RESISTANCE SK INNOVATION CO LTD (KR) 2013-03-27 EP disclosed
US-20120141702-A1 ETHYLENE COPOLYMER HAVING MULTIPLE PITCH IN MOLECULAR WEIGHT DISTRIBUTION AND THE METHOD OF PREPARING THE SAME SK ENERGY CO., LTD. (KR) 2012-06-07 US disclosed
US-20120041149-A1 ETHYLENE COPOLYMER AND A METHOD OF PREPARING THE SAME SK INNOVATION CO., LTD. (KR) 2012-02-16 US disclosed
US-8076428-B2 Ethylene copolymer having multiple pitch molecular weight distribution and the method of preparing the same SK ENERGY CO., LTD. (KR) 2011-12-13 US disclosed
US-8067511-B2 Ethylene copolymer and a method of preparing the same SK INNOVATION CO., LTD. (KR) 2011-11-29 US disclosed
EP-2365990-A2 ETHYLENE COPOLYMER WITH IMPROVED IMPACT RESISTANCE SK Energy Co., Ltd. (KR) 2011-09-21 EP disclosed
EP-2324067-A2 ETHYLENE COPOLYMER AND A METHOD OF PREPARING THE SAME SK Energy Co., Ltd. (KR) 2011-05-25 EP disclosed
US-20100234545-A1 ETHYLENE COPOLYMER HAVING MULTIPLE PITCH MOLECULAR WEIGHT DISTRIBUTION AND THE METHOD OF PREPARING THE SAME SK INNOVATION CO., LTD. (KR) 2010-09-16 US disclosed
WO-2010062036-A9 ETHYLENE COPOLYMER WITH IMPROVED IMPACT RESISTANCE SK ENERGY CO., LTD. (KR) 2010-08-05 WO disclosed
WO-2010062036-A2 ETHYLENE COPOLYMER WITH IMPROVED IMPACT RESISTANCE SK ENERGY CO., LTD. (KR) 2010-06-03 WO disclosed
EP-2185611-A2 ETHYLENE COPOLYMER HAVING MULTIPLE PITCH IN MOLECULAR WEIGHT DISTRIBUTION AND THE METHOD OF PREPARING THE SAME SK Energy Co., Ltd. (KR) 2010-05-19 EP disclosed
WO-2010030145-A2 ETHYLENE COPOLYMER AND A METHOD OF PREPARING THE SAME SK ENERGY CO., LTD. (KR) 2010-03-18 WO disclosed
US-7645715-B2 Bis-arylaryloxy catalytic system for producing ethylene homopolymers or ethylene copolymers with alpha-olefins SK ENERGY CO., LTD. (KR) 2010-01-12 US disclosed
WO-2009031798-A2 ETHYLENE COPOLYMER HAVING MULTIPLE PITCH IN MOLECULAR WEIGHT DISTRIBUTION AND THE METHOD OF PREPARING THE SAME SK ENERGY CO., LTD. (KR) 2009-03-12 WO disclosed
US-20070249490-A1 BIS-ARYLARYLOXY CATALYTIC SYSTEM FOR PRODUCING ETHYLENE HOMOPOLYMERS OR ETHYLENE COPOLYMERS WITH ALPHA-OLEFINS SK CORPORATION (KR) 2007-10-25 US disclosed