Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5853820

CCCCC(=O)N[Ti+2](C1C=Cc2ccccc21)[SiH](c1ccccc1)c1ccccc1.[Cl-].[Cl-]

nearest known ligand 0.35

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 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
TSHR P16473 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
POLB P06746 2/20 0.33
EPHX2 P34913 1/20 0.33
ASAH1 Q13510 1/20 0.33
ACER2 Q5QJU3 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ADORA1 P30542 1/20 0.33
CETP P11597 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PKM P14618 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HTT P42858 1/20 0.32

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 SCHEMBL5853354 0.97 EPHX2 (0.38) ALDH1A1POLBEPHX2ASAH1ACER2
Hydrochloric Acid SCHEMBL5853316 0.96 EPHX2 (0.39) ALDH1A1POLBEPHX2ASAH1ACER2
Hydrochloric Acid SCHEMBL5855117 0.96 EPHX2 (0.39) ALDH1A1POLBEPHX2ASAH1ACER2
Hydrochloric Acid SCHEMBL5853723 0.93 ALOX5 (0.35) ALDH1A1L3MBTL1ADORA1KDM4EHTT
Hydrochloric Acid SCHEMBL5853146 0.89 SIGMAR1 (0.31) TSHRL3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL5855132 0.88 TSHR (0.36) ALDH1A1TSHRNPSR1POLBEPHX2
Hydrochloric Acid SCHEMBL5853592 0.84 EPHX2 (0.37) ALDH1A1POLBEPHX2ASAH1ACER2
Hydrochloric Acid SCHEMBL5854933 0.83 EPHX2 (0.39) ALDH1A1POLBEPHX2ASAH1ACER2
Hydrochloric Acid SCHEMBL5853674 0.83 EPHX2 (0.39) ALDH1A1POLBEPHX2ASAH1ACER2
Hydrochloric Acid SCHEMBL5855400 0.83 MAPK1 (0.42) ALDH1A1TSHRPOLBL3MBTL1MEN1

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