Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5854094

CCCCC(CC)C(=O)N[Ti+2](C1=C(C)C(C)=C(C)C1C)[SiH](c1ccccc1)c1ccccc1.[Cl-].[Cl-]

nearest known ligand 0.42

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
MAPK1 P28482 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.38
TSHR P16473 2/20 0.37
LMNA P02545 1/20 0.36
CA2 P00918 4/20 0.35
CA1 P00915 3/20 0.35
CA7 P43166 1/20 0.34
CA14 Q9ULX7 1/20 0.34
POLB P06746 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33

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 SCHEMBL5855039 0.84 CA2 (0.40) MAPK1MEN1ALDH1A1MAPTKMT2A
Hydrochloric Acid SCHEMBL5853642 0.82 ALDH1A1 (0.35) MEN1ALDH1A1KMT2AL3MBTL1POLB
Hydrochloric Acid SCHEMBL5854295 0.81 EPHX2 (0.38) MEN1ALDH1A1KMT2ASMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL5855238 0.81 EPHX2 (0.40) MEN1ALDH1A1KMT2ALMNAPOLB
Hydrochloric Acid SCHEMBL5854189 0.80 ALOX5 (0.35) MAPK1MEN1ALDH1A1MAPTKMT2A
Hydrochloric Acid SCHEMBL5854070 0.80 GAA (0.31) ALDH1A1MAPTSMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL5853269 0.78 SMN1; SMN2 (0.30) SMN1; SMN2
Hydrochloric Acid SCHEMBL5853536 0.77 MAPK1 (0.42) MAPK1MEN1ALDH1A1MAPTKMT2A
Hydrochloric Acid SCHEMBL5854321 0.74 L3MBTL1 (0.34) L3MBTL1
Hydrochloric Acid SCHEMBL5853092 0.74 MAPK1 (0.42) MAPK1MEN1ALDH1A1MAPTKMT2A

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