Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5852836

CC1=C(C)C(C)C([Hf+2](NC(=O)c2ccccc2)[SiH](C)C)=C1C.[Cl-].[Cl-]

nearest known ligand 0.36

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
PTGS2 P35354 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
HPGD P15428 3/20 0.35
POLB P06746 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAPT P10636 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HDAC3 O15379 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
IDO1 P14902 1/20 0.34
ALOX15 P16050 1/20 0.34
HDAC1 Q13547 1/20 0.34
CA9 Q16790 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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 SCHEMBL5856484 0.87 HDAC8 (0.44) SMN1; SMN2POLBNPC1RAB9AHDAC8
Hydrochloric Acid SCHEMBL5853650 0.87 SMN1; SMN2 (0.33) PTGS2SMN1; SMN2HPGDPOLBNPC1
Hydrochloric Acid SCHEMBL5853417 0.84 HPGD (0.39) SMN1; SMN2HPGDPOLBNPC1RAB9A
Hydrochloric Acid SCHEMBL5853163 0.83 NR1H4 (0.41) SMN1; SMN2RAB9AHDAC3HDAC8HDAC6
Hydrochloric Acid SCHEMBL5855430 0.83 TYK2 (0.34) NPC1RAB9ATDP1
Hydrochloric Acid SCHEMBL5854332 0.81 KCNK3 (0.36) CYP3A4CYP2C19LMNAKMT2AALDH1A1
Hydrochloric Acid SCHEMBL5852541 0.81 ITGB1 (0.34) LMNA
Hydrochloric Acid SCHEMBL5855320 0.79 ITGB1 (0.33) SMN1; SMN2LMNAKMT2A
Hydrochloric Acid SCHEMBL5853626 0.78 SMN1; SMN2 (0.45) SMN1; SMN2POLBNPC1RAB9AMAPT
Hydrochloric Acid SCHEMBL5853986 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed