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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 8/20 | 0.36 |
| ▸ | SLC6A4 known ✓ | P31645 | 7/20 | 0.36 |
| ▸ | SLC6A3 known ✓ | Q01959 | 7/20 | 0.36 |
| ▸ | HTR2A known ✓ | P28223 | 4/20 | 0.36 |
| ▸ | HTR2B known ✓ | P41595 | 2/20 | 0.36 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.36 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.36 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.36 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.36 |
| ▸ | HRH1 known ✓ | P35367 | 1/20 | 0.32 |
| ▸ | OPRD1 known ✓ | P41143 | 1/20 | 0.32 |
| ▸ | OPRK1 known ✓ | P41145 | 1/20 | 0.32 |
| ▸ | HTR3A known ✓ | P46098 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL299620 | 0.98 | — | — | |
| Bromide SCHEMBL28138303 | 0.96 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| Iodide SCHEMBL28547995 | 0.96 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| Ammonia Solution, Strong SCHEMBL462091 | 0.96 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| Acrylamide SCHEMBL11341611 | 0.85 | ADRA2C (0.37) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| SCHEMBL16767730 | 0.82 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| SCHEMBL27749185 | 0.80 | HTR1D (0.35) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| SCHEMBL400952 | 0.79 | — | — | |
| SCHEMBL5941067 | 0.79 | ADRB2 (0.31) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| SCHEMBL15173596 | 0.78 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102101897-B | Heterocyclic-side-chain-containing metallocene catalyst and application thereof in olefinic polymerization | SHANGHAI RES INST CHEMICAL IND | 2013-02-06 | — | — | CN | claimed |
| CN-102101897-A | Heterocyclic-side-chain-containing metallocene catalyst and application thereof in olefinic polymerization | SHANGHAI RES INST CHEMICAL IND | 2011-06-22 | — | — | CN | claimed |
| US-4076632-A | PROTONATED DI-POLYETHOXY-MONOALKYL AMINE, UREA | THE PROCTER & GAMBLE COMPANY (US) | 1978-02-28 | — | — | US | claimed |
| CN-102473898-B | Electrode for secondary battery, slurry for secondary battery electrode, and secondary battery | ZEON CORP | 2015-03-04 | — | — | CN | disclosed |
| CN-102101897-B | Heterocyclic-side-chain-containing metallocene catalyst and application thereof in olefinic polymerization | SHANGHAI RES INST CHEMICAL IND | 2013-02-06 | — | — | CN | disclosed |
| CN-102101897-A | Heterocyclic-side-chain-containing metallocene catalyst and application thereof in olefinic polymerization | SHANGHAI RES INST CHEMICAL IND | 2011-06-22 | — | — | CN | disclosed |
| EP-0944609-B1 | PROCESS FOR PREPARING N-ALKYL AMMONIUM ACETONITRILE COMPOUNDS | CLOROX CO (US) | 2003-04-02 | — | — | EP | disclosed |
| US-4348292-A | Multi-layered liquid detergent-builder concentrate compositions which on addition to water produce stable cleaning solutions | WALTON-MARCH, INC. (US) | 1982-09-07 | — | — | US | disclosed |
| US-4334013-A | ALLYL AMMONIUM SALT | AGFA-GEVAERT AG (DE) | 1982-06-08 | — | — | US | disclosed |
| US-4329441-A | PHOSPHORUS COMPOUND CATALYST | AGFA-GEVAERT AG AKTIENGESELLSCHAFT (DE) | 1982-05-11 | — | — | US | disclosed |
| US-4242377-A | BY USE OF PRESSURIZED LIQUID CONDITIONER, AND LAUNDRY DRYER | COLGATE-PALMOLIVE COMPANY (US) | 1980-12-30 | — | — | US | disclosed |
| US-4041205-A | SURFACTANTS AND A REINFORCEMENT SELECTED FROM CELLULOSE, PROTEIN, AND NYLON | COLGATE-PALMOLIVE COMPANY (US) | 1977-08-09 | — | — | US | disclosed |