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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 known ✓ | P27487 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TGM2 | P21980 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 2/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6344239 | 0.81 | KAT2B (0.44) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| Water SCHEMBL9650623 | 0.78 | KAT2B (0.44) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL10483621 | 0.77 | ALDH1A1 (0.55) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL27701677 | 0.75 | TGM2 (0.48) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL176143 | 0.73 | TSHR (0.52) | ALDH1A1CYP2C19CYP3A4CYP2C9ACACB | |
| SCHEMBL17183807 | 0.72 | TACR3 (0.46) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL4415392 | 0.72 | TDP1 (0.63) | ALDH1A1LMNAPOLBMEN1KMT2A | |
| SCHEMBL28207649 | 0.72 | TDP1 (0.63) | ALDH1A1LMNAPOLBMEN1KMT2A | |
| SCHEMBL5527681 | 0.72 | TDP1 (0.63) | ALDH1A1LMNAPOLBMEN1KMT2A | |
| SCHEMBL17320255 | 0.71 | TGM2 (0.52) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109970900-A | The preparation method of attapulgite modified cation styrene-acrylic emulsion | 中科院广州能源所盱眙凹土研发中心 | 2019-07-05 | — | — | CN | claimed |
| CN-106549186-A | The preparation method of attapulgite hydridization polymethyl methacrylate lithium battery gel electrolyte | 中国科学院广州能源研究所 | 2017-03-29 | — | — | CN | claimed |
| CN-104974300-B | Resistance reducing agent for fracture and preparation method thereof | 中国石油化工股份有限公司 | 2017-02-15 | — | — | CN | claimed |
| CN-104974308-A | Resistance reducing agent for fracture and preparation method thereof | CHINA PETROLEUM & CHEMICAL | 2015-10-14 | — | — | CN | claimed |
| CN-104974300-A | Resistance reducing agent for fracture and preparation method thereof | CHINA PETROLEUM & CHEMICAL | 2015-10-14 | — | — | CN | claimed |
| CN-111471130-A | Resistance reducing agent for online mixing variable viscosity fracturing and preparation method thereof | 北京金圣奥能源技术有限公司 | 2020-07-31 | — | — | CN | disclosed |
| CN-109970900-A | The preparation method of attapulgite modified cation styrene-acrylic emulsion | 中科院广州能源所盱眙凹土研发中心 | 2019-07-05 | — | — | CN | disclosed |
| CN-106549186-B | The preparation method of attapulgite hydridization polymethyl methacrylate lithium battery gel electrolyte | 中国科学院广州能源研究所 | 2019-03-05 | — | — | CN | disclosed |
| CN-104974737-B | A kind of pressure break friction reducer and preparation method thereof | 中国石油化工股份有限公司 | 2018-09-21 | — | — | CN | disclosed |
| CN-104974308-B | A kind of pressure break friction reducer and preparation method thereof | 中国石油化工股份有限公司 | 2017-09-26 | — | — | CN | disclosed |
| CN-104974298-B | Resistance reducing agent for fracture and preparation method thereof | 中国石油化工股份有限公司 | 2017-04-26 | — | — | CN | disclosed |
| CN-106549186-A | The preparation method of attapulgite hydridization polymethyl methacrylate lithium battery gel electrolyte | 中国科学院广州能源研究所 | 2017-03-29 | — | — | CN | disclosed |
| CN-104974300-B | Resistance reducing agent for fracture and preparation method thereof | 中国石油化工股份有限公司 | 2017-02-15 | — | — | CN | disclosed |
| CN-104974308-A | Resistance reducing agent for fracture and preparation method thereof | CHINA PETROLEUM & CHEMICAL | 2015-10-14 | — | — | CN | disclosed |
| CN-104974300-A | Resistance reducing agent for fracture and preparation method thereof | CHINA PETROLEUM & CHEMICAL | 2015-10-14 | — | — | CN | disclosed |