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 | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 2/20 | 0.39 |
| ▸ | CHRM4 known ✓ | P08173 | 2/20 | 0.39 |
| ▸ | CHRM5 known ✓ | P08912 | 2/20 | 0.39 |
| ▸ | CHRM1 known ✓ | P11229 | 2/20 | 0.39 |
| ▸ | CHRM3 known ✓ | P20309 | 2/20 | 0.39 |
| ▸ | GAA known ✓ | P10253 | 2/20 | 0.38 |
| ▸ | AGTR1 known ✓ | P30556 | 1/20 | 0.36 |
| ▸ | SCN4A known ✓ | P35499 | 1/20 | 0.35 |
| ▸ | HTR3A known ✓ | P46098 | 1/20 | 0.35 |
| ▸ | SCN5A known ✓ | Q14524 | 1/20 | 0.35 |
| ▸ | SCN9A known ✓ | Q15858 | 1/20 | 0.35 |
| ▸ | SCN3A known ✓ | Q9NY46 | 1/20 | 0.35 |
| ▸ | OPRK1 known ✓ | P41145 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL442212 | 0.97 | — | — | |
| Acetic Acid SCHEMBL2672332 | 0.92 | ALDH1A1 (0.40) | ALDH1A1TDP1TRPA1CHRM2CHRM4 | |
| SCHEMBL20067016 | 0.91 | ALDH1A1 (0.44) | ALDH1A1TDP1TRPA1CHRM2CHRM4 | |
| Sulfuric Acid SCHEMBL2672044 | 0.87 | NPSR1 (0.38) | ALDH1A1TDP1TRPA1CHRM2CHRM4 | |
| Hydrochloric Acid SCHEMBL4948054 | 0.84 | TRPA1 (0.47) | ALDH1A1TDP1TRPA1CHRM2LMNA | |
| SCHEMBL13606597 | 0.83 | TRPA1 (0.43) | ALDH1A1TDP1TRPA1CHRM2CHRM4 | |
| SCHEMBL15131038 | 0.81 | TDP1 (0.48) | ALDH1A1TDP1TRPA1CHRM2CHRM4 | |
| SCHEMBL14286307 | 0.81 | ALDH1A1 (0.36) | ALDH1A1TDP1TRPA1CHRM2CHRM4 | |
| SCHEMBL12082045 | 0.81 | — | — | |
| SCHEMBL18184571 | 0.81 | CA12 (0.41) | ALDH1A1TDP1TRPA1CHRM2CHRM4 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090289221-A1 | Use Of Aminoacetones And Salts Thereof As Bleaching Boosters For Peroxygen Compounds | CLARIANT FINANCE (BVI) LIMITED (VG) | 2009-11-26 | — | — | US | claimed |
| EP-2046933-B1 | DETERGENT COMPOSITION | RECKITT BENCKISER NV (NL) | 2015-07-15 | — | — | EP | disclosed |
| US-8173587-B2 | Detergent composition | RECKITT BENCKISER N.V. (NL) | 2012-05-08 | — | — | US | disclosed |
| US-20090325840-A1 | Detergent Composition | RECKITT BENCKISER N.V. (NL) | 2009-12-31 | — | — | US | disclosed |
| US-20090289221-A1 | Use Of Aminoacetones And Salts Thereof As Bleaching Boosters For Peroxygen Compounds | CLARIANT FINANCE (BVI) LIMITED (VG) | 2009-11-26 | — | — | US | disclosed |
| EP-2049643-A1 | USE OF AMINOACETONES AND SALTS THEREOF AS BLEACHING BOOSTERS FOR PEROXYGEN COMPOUNDS | Clariant Finance (BVI) Limited (VG) | 2009-04-22 | — | — | EP | disclosed |
| EP-2046933-A1 | DETERGENT COMPOSITION | Reckitt Benckiser N.V. (NL) | 2009-04-15 | — | — | EP | disclosed |
| WO-2008015443-A1 | DETERGENT COMPOSITION | RECKITT BENCKISER N.V. (NL) | 2008-02-07 | — | — | WO | disclosed |
| WO-2008014965-A1 | USE OF AMINOACETONES AND SALTS THEREOF AS BLEACHING BOOSTERS FOR PEROXYGEN COMPOUNDS | CLARIANT FINANCE (BVI) LIMITED (VG) | 2008-02-07 | — | — | WO | disclosed |