Hydrochloric Acid

Hydrochloric Acid

SCHEMBL27640262

CC(=O)c1ccc2cccc([N+](=O)[O-])c2c1O.[Cl-].[Cl-].[Cl-].[V+3]

nearest known ligand 0.46

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
GPR35 Q9HC97 2/20 0.46
ERN1 O75460 1/20 0.42
TSHR P16473 2/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
P2RX1 P51575 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
TNF P01375 2/20 0.39
NOD1 Q9Y239 2/20 0.39
PDE10A Q9Y233 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
TYMS P04818 1/20 0.39
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL27728331 0.97 GPR35 (0.49) GPR35ERN1TSHRMEN1KMT2A
SCHEMBL12920010 0.82 TSHR (0.51) GPR35TSHRMEN1KMT2AALDH1A1
SCHEMBL312392 0.78 GPR35 (0.64) GPR35ERN1TSHRMEN1KMT2A
SCHEMBL29506396 0.78 GPR35 (0.64) GPR35ERN1TSHRMEN1KMT2A
Acetone SCHEMBL27618861 0.78 TDP1 (0.52) GPR35ERN1TSHRMEN1KMT2A
SCHEMBL12800164 0.75 MAPT (0.49) TSHRMEN1KMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL27640197 0.74 ERN1 (0.49) GPR35ERN1TSHRMEN1KMT2A
SCHEMBL8974158 0.73 ALDH1A1 (0.47) TSHRMEN1KMT2AALDH1A1KDM4E
SCHEMBL187697 0.72 ALDH1A1 (0.61) GPR35TSHRMEN1KMT2AALDH1A1
SCHEMBL29626558 0.72 ALDH1A1 (0.61) GPR35TSHRMEN1KMT2AALDH1A1

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