Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3625537

CC1=C(C)C(C)(C)C([Ti+2]Oc2ccccc2-c2ccccc2)=C1C.[Cl-].[Cl-]

nearest known ligand 0.34

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
HTR7 P34969 1/20 0.34
ADRB2 P07550 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
MAPK1 P28482 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
RAB9A P51151 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
ALDH1A1 P00352 2/20 0.32
ADRA2A P08913 3/20 0.32
ADRA2B P18089 3/20 0.32
ADRA2C P18825 3/20 0.32
MAOA P21397 3/20 0.32
MAOB P27338 3/20 0.32
NISCH Q9Y2I1 1/20 0.32
ADRB1 P08588 1/20 0.31
HRH1 P35367 1/20 0.31
MEN1 O00255 1/20 0.31

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 SCHEMBL3615425 0.82 MEN1 (0.33) RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL3611287 0.72 HTR7 (0.35) HTR7ADRB2L3MBTL1MAPK1TDP1
Hydrochloric Acid SCHEMBL15746629 0.72 KDM4E (0.31) HTR7LMNARAB9AALDH1A1MAOA
Hydrochloric Acid SCHEMBL15746625 0.71 ESR1 (0.30) ALDH1A1
Hydrochloric Acid SCHEMBL346593 0.71 ADRA2A (0.34) HTR7ADRB2L3MBTL1MAPK1TDP1
Hydrochloric Acid SCHEMBL392238 0.71
SCHEMBL3676430 0.70 L3MBTL1 (0.35) HTR7ADRB2L3MBTL1MAPK1TDP1
SCHEMBL370497 0.70 HTR7 (0.35) HTR7ADRB2L3MBTL1MAPK1TDP1
Hydrochloric Acid SCHEMBL3625539 0.69 MAPK1 (0.36) HTR7ADRB2L3MBTL1MAPK1TDP1
SCHEMBL22186612 0.67 HTR7 (0.37) HTR7ADRB2L3MBTL1MAPK1TDP1

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-2010576-B1 BIS-ARYLARYLOXY CATALYTIC SYSTEM FOR PRODUCING ETHYLENE HOMOPOLYMERS OR ETHYLENE COPOLYMERS WITH ALPHA-OLEFINS SK INNOVATION CO LTD (KR) 2013-07-24 EP disclosed
US-7645715-B2 Bis-arylaryloxy catalytic system for producing ethylene homopolymers or ethylene copolymers with alpha-olefins SK ENERGY CO., LTD. (KR) 2010-01-12 US disclosed
EP-2010576-A1 BIS-ARYLARYLOXY CATALYTIC SYSTEM FOR PRODUCING ETHYLENE HOMOPOLYMERS OR ETHYLENE COPOLYMERS WITH ALPHA-OLEFINS SK Energy Co., Ltd. (KR) 2009-01-07 EP disclosed
WO-2007123362-A1 BIS-ARYLARYLOXY CATALYTIC SYSTEM FOR PRODUCING ETHYLENE HOMOPOLYMERS OR ETHYLENE COPOLYMERS WITH ALPHA-OLEFINS SK ENERGY CO., LTD. (KR) 2007-11-01 WO disclosed
US-20070249490-A1 BIS-ARYLARYLOXY CATALYTIC SYSTEM FOR PRODUCING ETHYLENE HOMOPOLYMERS OR ETHYLENE COPOLYMERS WITH ALPHA-OLEFINS SK CORPORATION (KR) 2007-10-25 US disclosed