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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR2 | O15552 | 17/20 | 0.62 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
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 SCHEMBL9862940 | 1.00 | FFAR2 (0.62) | FFAR2AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL1677207 | 0.98 | FFAR2 (0.65) | FFAR2AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL1405698 | 0.98 | FFAR2 (0.65) | FFAR2AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL68169 | 0.98 | FFAR2 (0.65) | FFAR2AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL27563008 | 0.96 | FFAR2 (0.62) | FFAR2AKR1C3AKR1C2MEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL10607681 | 0.96 | FFAR2 (0.62) | FFAR2AKR1C3AKR1C2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL10916853 | 0.88 | AKR1C3 (0.51) | FFAR2AKR1C3AKR1C2 | |
| Benzil SCHEMBL27273806 | 0.86 | CES2 (0.59) | FFAR2LMNA | |
| SCHEMBL7525386 | 0.84 | FFAR2 (0.53) | FFAR2MEN1KMT2ALMNA | |
| SCHEMBL9871299 | 0.82 | FFAR2 (0.61) | FFAR2MEN1KMT2ALMNA |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4211727-A | CADMIUM BOROHYDRIDE COMPLEX AS REDUCING AGENT | SHELL OIL COMPANY (US) | 1980-07-08 | — | — | US | claimed |
| US-4153626-A | Preparation of α-cyanobenzyl esters | SHELL OIL COMPANY (US) | 1979-05-08 | — | — | US | claimed |
| US-4985365-A | WITH AN ESTERASE FROM A MICROORGANISM, ASSYMETRIC HYDROLYSIS | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1991-01-15 | — | — | US | disclosed |
| EP-0118163-B1 | METHOD FOR BIOTECHNOLOGICALLY PREPARING OPTICALLY ACTIVE ALPHA-CYANO-3-PHENOXYBENZYL ALCOHOL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1988-04-20 | — | — | EP | disclosed |
| EP-0080827-B1 | METHOD FOR BIOTECHNOLOGICALLY PREPARING (S)-(-)-ALPHA-CYANO-3-PHENOXYBENZYL ALCOHOL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1988-03-09 | — | — | EP | disclosed |
| EP-0118163-A1 | Method for biotechnologically preparing optically active alpha-cyano-3-phenoxybenzyl alcohol | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1984-09-12 | — | — | EP | disclosed |
| US-4390543-A | Substituted pyridine methyl esters of 2-isopropyl-2-(4-chlorophenyl) acetic acid and their use as insecticides | MALHOTRA SUDARSHAN K | 1983-06-28 | — | — | US | disclosed |
| EP-0080827-A2 | Method for biotechnologically preparing (S)-(-)-alpha-cyano-3-phenoxybenzyl alcohol | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1983-06-08 | — | — | EP | disclosed |
| US-4350640-A | FROM APPROPRIATE ACID CHLORIDE, WATER-SOLUBLE CYANIDE AND 3-PHENOXYBENZALDEHYDE | BAYER AKTIENGESELLSCHAFT (DE) | 1982-09-21 | — | — | US | disclosed |
| US-4345090-A | ESTERIFICATION | BAYER AKTIENGESELLSCHAFT (DE) | 1982-08-17 | — | — | US | disclosed |
| US-4301156-A | FOR MOTHS | THE DOW CHEMICAL COMPANY (US) | 1981-11-17 | — | — | US | disclosed |
| EP-0037851-A2 | Carboxylates, a process for their production, an insecticidal and/or acaricidal composition and the use of the compounds as insecticides and/or acaricides | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1981-10-21 | — | — | EP | disclosed |
| US-4271186-A | Stilbene compounds and insecticidal/acaricidal compositions | BAYER AKTIENGESELLSCHAFT (DE) | 1981-06-02 | — | — | US | disclosed |
| US-4262001-A | MITICIDES, PARASITICIDES, LARVICIDES | THE DOW CHEMICAL COMPANY (US) | 1981-04-14 | — | — | US | disclosed |
| EP-0026650-A2 | Insecticidal synergistic mixtures of 0,0-diethyl 0-(3,5,6-trichloro-2-pyridinyl)phosphorothioate and 4-chloro-alpha-(1-methylethyl)benzene-acetic acid:cyano(6-phenoxy-2-pyridinyl)methyl ester and method of killing and controlling insects | THE DOW CHEMICAL COMPANY (US) | 1981-04-08 | — | — | EP | disclosed |
| US-4259497-A | INSECTICIDES | PHILAGRO (FR) | 1981-03-31 | — | — | US | disclosed |
| US-4242357-A | INSECTICIDES, MITICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1980-12-30 | — | — | US | disclosed |
| US-4228172-A | Substituted pyridine methyl esters of 2-isopropyl-2-(4-chlorophenyl)acetic acid and their use as insecticides | THE DOW CHEMICAL COMPANY (US) | 1980-10-14 | — | — | US | disclosed |
| US-4199596-A | ESTERS, INSECTICIDES, MITICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1980-04-22 | — | — | US | disclosed |
| US-4172135-A | PESTICIDES | CIBA-GEIGY CORPORATION (US) | 1979-10-23 | — | — | US | disclosed |