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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 known ✓ | P35354 | 2/20 | 0.45 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.43 |
| ▸ | GAA known ✓ | P10253 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.96 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.44 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.44 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.41 |
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 SCHEMBL5623816 | 1.00 | NAPRT (0.96) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 | |
| SCHEMBL65447 | 0.98 | NAPRT (1.00) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 | |
| SCHEMBL29727824 | 0.98 | NAPRT (1.00) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 | |
| Magnesium SCHEMBL31053907 | 0.96 | NAPRT (0.96) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 | |
| SCHEMBL5082269 | 0.96 | NAPRT (0.96) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 | |
| SCHEMBL1649252 | 0.96 | NAPRT (0.96) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 | |
| SCHEMBL8022059 | 0.96 | NAPRT (0.96) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 | |
| Ammonia Solution, Strong SCHEMBL8023386 | 0.96 | NAPRT (0.96) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 | |
| Ammonia Solution, Strong SCHEMBL8023381 | 0.96 | NAPRT (0.96) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 | |
| Water SCHEMBL28999632 | 0.96 | NAPRT (0.96) | NAPRTTSHRSMN1; SMN2KDM4EPTGS2 |
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 194 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106366071-B | The preparation method of Vonoprazan fumarate | 山东金城医药集团股份有限公司 | 2019-05-07 | — | — | CN | claimed |
| CN-109320520-A | A kind of rhodamine B Hg based on pyridine -3- sulfonic acid chloride2+The preparation and application of fluorescent optical sensor | 南京林业大学 | 2019-02-12 | — | — | CN | claimed |
| CN-106187852-B | A kind of preparation method of Vonoprazan fumarate intermediate | 江西同和药业股份有限公司 | 2019-01-15 | — | — | CN | claimed |
| CN-109053684-A | A kind of preparation method of Vonoprazan fumarate and its intermediate | 珠海润都制药股份有限公司 | 2018-12-21 | — | — | CN | claimed |
| CN-108892671-A | A kind of preparation method of pyroxsulam | 常州沃腾化工科技有限公司 | 2018-11-27 | — | — | CN | claimed |
| CN-108503621-A | A kind of preparation method of Vonoprazan fumarate | 上海中拓医药科技有限公司 | 2018-09-07 | — | — | CN | claimed |
| CN-105143187-B | The method for preparing sulfonyl chloride compound | 武田药品工业株式会社 | 2018-04-03 | — | — | CN | claimed |
| CN-106397404-A | Method for preparing 5-(2-fluorophenyl)-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carboxaldehyde | 山东新华制药股份有限公司 | 2017-02-15 | — | — | CN | claimed |
| CN-106366071-A | Vonoprazan fumarate preparation method | 山东金城医药股份有限公司 | 2017-02-01 | — | — | CN | claimed |
| CN-106198852-A | The method measuring pyridine-3-sulfonic acid chloride content | 中美华世通生物医药科技（武汉）有限公司 | 2016-12-07 | — | — | CN | claimed |
| CN-106187852-A | A kind of preparation method of Vonoprazan fumarate intermediate | 江西同和药业股份有限公司 | 2016-12-07 | — | — | CN | claimed |
| CN-106146466-A | Vonoprazan fumarate intermediate, preparation method thereof and method for preparing Vonoprazan fumarate intermediate | 珠海赛隆药业股份有限公司（长沙）医药研发中心 | 2016-11-23 | — | — | CN | claimed |
| CN-105612150-A | Sulfonylindole derivatives and process for producing the same | DAE WOONG PHARMA | 2016-05-25 | — | — | CN | claimed |
| CN-1185547-C | IR- and UV-radiation-sensitive composition and lithographic plate | LASTRA SPA (IT) | 2005-01-19 | — | — | CN | claimed |
| CN-1241731-A | IR- and UV-radiation-sensitive composition and lithographic plate | LASTRA SPA (IT) | 2000-01-19 | — | — | CN | claimed |
| CN-103543607-B | Organic EL element, radiation sensitive linear resin composition and cured film | JSR株式会社 | 2019-11-29 | — | — | CN | disclosed |
| CN-110446708-A | Chemical compound | ANTABIO SAS | 2019-11-12 | — | — | CN | disclosed |
| CN-1191992-A | Radiation-sensitive composition adapted for roller coating | CLARIANT INT LTD (CH) | 1998-09-02 | — | — | CN | disclosed |
| CN-1026048-C | Use of solsonylurea compounds as herbicide | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1994-10-05 | — | — | CN | disclosed |
| CN-1059073-A | Solsonylurea compounds is as the purposes of weed killer herbicide | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1992-03-04 | — | — | CN | disclosed |