Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5854293

CCCCC(=O)N[Ti+2](C1=CC=CC1)[SiH](C)C.[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 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.32
GAA P10253 1/20 0.32
MAPK10 P53779 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 3/20 0.31
KDM4E B2RXH2 2/20 0.31
TP53 P04637 1/20 0.31
RAB9A P51151 1/20 0.31
CETP P11597 1/20 0.31
HTT P42858 2/20 0.30
CYP1A2 P05177 2/20 0.30
CYP2C19 P33261 2/20 0.30
CYP3A4 P08684 1/20 0.30
NAAA Q02083 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30

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 SCHEMBL5854185 0.96 HSP90AA1 (0.35) ALDH1A1HPGDNAAA
Hydrochloric Acid SCHEMBL5852782 0.95 HSP90AA1 (0.37) NAAA
Hydrochloric Acid SCHEMBL5855751 0.95 HSP90AA1 (0.37) NAAA
Hydrochloric Acid SCHEMBL5856452 0.92 TP53 (0.31) ALDH1A1TP53
Hydrochloric Acid SCHEMBL5854156 0.86
Hydrochloric Acid SCHEMBL5855270 0.79 ALDH1A1 (0.32) ALDH1A1GAAMAPK10SMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL5852710 0.78
Hydrochloric Acid SCHEMBL5853889 0.75 NAAA (0.33) ALDH1A1HPGDNAAA
Hydrochloric Acid SCHEMBL5856711 0.74 HSP90AA1 (0.36) ALDH1A1NAAA
Hydrochloric Acid SCHEMBL5854811 0.74 HSP90AA1 (0.36) ALDH1A1NAAA

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