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 | |
|---|---|---|---|---|
| ▸ | GAA known ✓ | P10253 | 2/20 | 0.34 |
| ▸ | S1PR4 known ✓ | O95977 | 1/20 | 0.33 |
| ▸ | HSP90AA1 known ✓ | P07900 | 1/20 | 0.33 |
| ▸ | S1PR1 known ✓ | P21453 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | CRHBP | P24387 | 2/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.39 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.39 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | UBE2N | P61088 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4210973 | 0.98 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2AL3MBTL1ATM | |
| Aziridine SCHEMBL29221600 | 0.90 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2AL3MBTL1ATM | |
| Hydrochloric Acid SCHEMBL15527206 | 0.81 | KMT2A (0.39) | ALDH1A1MEN1KMT2AL3MBTL1ATM | |
| SCHEMBL4373512 | 0.81 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2AL3MBTL1ATM | |
| SCHEMBL4384248 | 0.79 | ALDH1A1 (0.40) | ALDH1A1MEN1KMT2AL3MBTL1ATM | |
| SCHEMBL9034396 | 0.79 | ALDH1A1 (0.37) | ALDH1A1MEN1KMT2AL3MBTL1ATM | |
| SCHEMBL28950933 | 0.76 | NPSR1 (0.48) | ALDH1A1MEN1KMT2AL3MBTL1ATM | |
| SCHEMBL175271 | 0.76 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2AL3MBTL1ATM | |
| SCHEMBL11880568 | 0.75 | MEN1 (0.38) | ALDH1A1MEN1KMT2AL3MBTL1ATM | |
| SCHEMBL11807607 | 0.75 | MEN1 (0.38) | ALDH1A1MEN1KMT2AL3MBTL1ATM |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1107056-C | Novel process for preparation of clonidine derivatives | ALOCON LAB INC (US) | 2003-04-30 | — | — | CN | claimed |
| CN-1220261-A | Novel process for preparation of clonidine derivatives | ALCON LAB INC (US) | 1999-06-23 | — | — | CN | claimed |
| US-5684156-A | Process for preparation of clonidine derivatives | ALCON RESEARCH, LTD. | 1997-11-04 | — | — | US | claimed |
| EP-0693055-B1 | NOVEL PROCESS FOR PREPARATION OF CLONIDINE DERIVATIVES | ALCON LAB INC (US) | 1997-05-21 | — | — | EP | claimed |
| CN-1123026-A | Novel process for preparing clonidine derivatives | ALCON LAB INC (US) | 1996-05-22 | — | — | CN | claimed |
| EP-0693055-A1 | NOVEL PROCESS FOR PREPARATION OF CLONIDINE DERIVATIVES | ALCON LAB INC (US) | 1996-01-24 | — | — | EP | claimed |
| WO-1995021818-A1 | NOVEL PROCESS FOR PREPARATION OF CLONIDINE DERIVATIVES | ALCON LABORATORIES, INC. (US) | 1995-08-17 | — | — | WO | claimed |
| US-5684156-A | Process for preparation of clonidine derivatives | ALCON RESEARCH, LTD. | 1997-11-04 | — | — | US | disclosed |
| EP-0693055-B1 | NOVEL PROCESS FOR PREPARATION OF CLONIDINE DERIVATIVES | ALCON LAB INC (US) | 1997-05-21 | — | — | EP | disclosed |
| EP-0693055-A1 | NOVEL PROCESS FOR PREPARATION OF CLONIDINE DERIVATIVES | ALCON LAB INC (US) | 1996-01-24 | — | — | EP | disclosed |
| WO-1995021818-A1 | NOVEL PROCESS FOR PREPARATION OF CLONIDINE DERIVATIVES | ALCON LABORATORIES, INC. (US) | 1995-08-17 | — | — | WO | disclosed |