Hydrochloric Acid

Hydrochloric Acid

SCHEMBL27660988

CC(=O)c1cc([N+](=O)[O-])c2ccccc2c1O.[Cl-].[Cl-].[Cl-].[V+3]

nearest known ligand 0.57

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 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.57
▸ MEN1 O00255 4/20 0.57
▸ MAPT P10636 4/20 0.57
▸ KMT2A Q03164 4/20 0.57
▸ NSD2 O96028 1/20 0.57
▸ POLB P06746 1/20 0.57
▸ MCL1 Q07820 1/20 0.57
▸ CTSB P07858 5/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ GAA P10253 1/20 0.47
▸ IDO1 P14902 1/20 0.47
▸ TDO2 P48775 1/20 0.47
▸ CASP6 P55212 1/20 0.46
▸ S100A4 P26447 1/20 0.44
▸ PKM P14618 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ HPRT1 P00492 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL27707704 0.97 MAPT (0.60) KDM4EMEN1MAPTKMT2ANSD2
SCHEMBL29401731 0.77 CASP6 (0.62) KDM4EMEN1MAPTKMT2APOLB
SCHEMBL458 0.77 CASP6 (0.62) KDM4EMEN1MAPTKMT2APOLB
SCHEMBL26656853 0.76 CTSB (0.58) KDM4EMEN1MAPTKMT2ACTSB
SCHEMBL10489198 0.75 ALOX5 (0.50) KDM4EMEN1MAPTKMT2ANSD2
SCHEMBL1740621 0.75 CASP6 (0.61) KDM4EMEN1MAPTKMT2APOLB
SCHEMBL8483724 0.75 CTSB (0.61) KDM4EMEN1MAPTKMT2APOLB
SCHEMBL1740623 0.75 CASP6 (0.61) KDM4EMEN1MAPTKMT2APOLB
SCHEMBL11701285 0.74 MAPT (0.72) KDM4EMEN1MAPTKMT2APOLB
SCHEMBL29904678 0.73 MAPT (1.00) KDM4EMEN1MAPTKMT2ANSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101357958-B Supported vanadium oxide non-metallocene catalyst for polyethylene and preparation method CHINA PETROCHEMICAL CORP 2010-08-25 — — CN disclosed
CN-100460423-C In-situ synthesized supported vanadium non-metallocene polyolefin catalyst and its prepn and application CHINA PETROLEUM & CHEMICAL (CN) 2009-02-11 — — CN disclosed
CN-100460424-C Vanadium non-metallocene polyolefin catalyst and its prepn and application CHINA PETROLEUM & CHEMICAL (CN) 2009-02-11 — — CN disclosed
CN-101357958-A Supported vanadium oxide non-metallocene catalyst for polyethylene and preparation method CHINA PETROCHEMICAL CORP (CN) 2009-02-04 — — CN disclosed
CN-1887920-A Vanadium non-metallocene polyolefin catalyst and its prepn and application CHINA PETROCHEMICAL CORP (CN) 2007-01-03 — — CN disclosed
CN-1887919-A In-situ synthesized supported vanadium non-metallocene polyolefin catalyst and its prepn and application CHINA PETROCHEMICAL CORP (CN) 2007-01-03 — — CN disclosed
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