Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3267591

C1=C([Zr+2](C2=CCc3c2ccc2ccc4ccccc4c32)=C(c2ccccc2)c2ccccc2)c2ccc3ccc4ccccc4c3c2C1.[Cl-].[Cl-]

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTT P42858 1/20 0.30
CDK5 Q00535 1/20 0.30
CDK5R1 Q15078 1/20 0.30
NCOA1 Q15788 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NCOA3 Q9Y6Q9 1/20 0.30

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.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL3271567 0.82 KDM4E (0.32) KDM4EALDH1A1CYP1A2HPGDCYP2C19
Hydrochloric Acid SCHEMBL3266036 0.81 KDM4E (0.31) KDM4EALDH1A1CYP1A2HPGDCYP2C19
Hydrochloric Acid SCHEMBL6156307 0.80 ALDH1A1 (0.33) RAB9AL3MBTL1KDM4EALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL3266632 0.77
Hydrochloric Acid SCHEMBL6909328 0.75 NPC1 (0.31) NPC1RAB9AL3MBTL1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL5179340 0.72 ALDH1A1 (0.38) RAB9AL3MBTL1KDM4EALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL6911511 0.69 ALDH1A1 (0.33) RAB9AL3MBTL1KDM4EALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL5599805 0.67 HPGD (0.34) RAB9AL3MBTL1KDM4EALDH1A1CYP1A2
SCHEMBL12023151 0.60 PTPN22 (0.52) RAB9AL3MBTL1ALDH1A1CYP1A2HPGD
SCHEMBL535635 0.59 HSD17B10 (0.69) RAB9AL3MBTL1ALDH1A1CYP1A2HPGD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1170313-B1 CROSS-COPOLYMERIZED OLEFIN/STYRENE/DIENE COPOLYMER, PROCESS FOR THE PRODUCTION OF THE SAME AND USES THEREOF DENKI KAGAKU KOGYO KK (JP) 2010-06-02 EP disclosed
US-6790917-B2 POLYMERIZING A VINYL COMPOUND IN PRESENCE OF A CATALYST OBTAINED BY COMBINING ORGANOTRANSITION METAL COMPOUND, AN ALUMINUM COMPUND OR ALUMOXANE AND A BORON COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-09-14 US disclosed
US-6559234-B1 Firstly provides a novel olefin/styrene/ diene type cross-copolymer having excellent physical properties and mechanical properties, and a novel, efficient and economically excellent process for its production. It provides an efficient DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2003-05-06 US disclosed
US-20020198340-A1 Process for producing vinyl compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-26 US disclosed
EP-1170313-A1 CROSS-COPOLYMERIZED OLEFIN/STYRENE/DIENE COPOLYMER, PROCESS FOR THE PRODUCTION OF THE SAME AND USES THEREOF DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-01-09 EP disclosed