Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5854796

CCCC(=O)N[Ti+2](C1c2ccccc2-c2ccccc21)[SiH](C)C.[Cl-].[Cl-]

nearest known ligand 0.40

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
ACHE known ✓ P22303 1/20 0.34
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP2 O95551 1/20 0.37
PAX8 Q06710 1/20 0.37
HKDC1 Q2TB90 1/20 0.37
TLR9 Q9NR96 1/20 0.37
ALOX5 P09917 1/20 0.37
PTPRC P08575 2/20 0.36
MAPK1 P28482 1/20 0.36
MTNR1A P48039 4/20 0.36
MTNR1B P49286 4/20 0.36
PARP14 Q460N5 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 2/20 0.35

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 SCHEMBL5853455 0.92 BCHE (0.38) NPC1RAB9AMEN1KMT2AMAPK1
Hydrochloric Acid SCHEMBL5855015 0.91 SOAT1 (0.42) NPC1RAB9AMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL5854083 0.90 SOAT1 (0.44) NPC1RAB9AMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL5853945 0.90 SOAT1 (0.44) NPC1RAB9AMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL5853478 0.89 MAPT (0.36) NPC1RAB9AMEN1KMT2AMAPK1
Hydrochloric Acid SCHEMBL5853220 0.86 ALOX5 (0.38) NPC1RAB9AMEN1PKMKMT2A
Hydrochloric Acid SCHEMBL5856705 0.81 POLB (0.40) MEN1KMT2AMTNR1AMTNR1BMAPT
Hydrochloric Acid SCHEMBL5852742 0.79 KMT2A (0.42) MEN1KMT2ATDP2MAPK1ALDH1A1
Hydrochloric Acid SCHEMBL5855246 0.79 SOAT1 (0.38) NPC1RAB9AMEN1KMT2AMAPK1
Hydrochloric Acid SCHEMBL5855778 0.78 HDAC3 (0.35) MEN1KMT2APTPRCALDH1A1MAPT

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