Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7199844

Cc1cccc([P+](Cc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)(c2cccc(C)c2)c2cccc(C)c2)c1.[Cl-]

nearest known ligand 0.50

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 2/20 0.50
TSHR P16473 4/20 0.50
ALOX5 P09917 2/20 0.43
LMNA P02545 2/20 0.41
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
RAB9A P51151 1/20 0.36
HPGD P15428 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
Bromide SCHEMBL7194050 0.97 TSHR (0.50) TSHRACHEALOX5LMNAMAPT
Iodide SCHEMBL7197607 0.97 TSHR (0.50) TSHRACHEALOX5LMNAMAPT
Acetic Acid SCHEMBL8750071 0.93 TSHR (0.46) TSHRACHEALOX5LMNAMAPT
Phosphoric Acid SCHEMBL7195772 0.93 TSHR (0.46) TSHRACHEALOX5LMNAMAPT
Phosphoric Acid SCHEMBL7195789 0.92 TSHR (0.45) TSHRACHEALOX5LMNAMAPT
Acetic Acid SCHEMBL7195843 0.91 ALOX5 (0.44) TSHRACHEALOX5MAPTMEN1
Succinic Acid SCHEMBL7195837 0.90 ALOX5 (0.43) TSHRACHEALOX5MAPTMEN1
Hydrochloric Acid SCHEMBL7196958 0.84 ACHE (0.47) TSHRACHELMNAMAPTMEN1
Bromide SCHEMBL7198157 0.81 ACHE (0.47) TSHRACHELMNAMAPTMEN1
Iodide SCHEMBL7199742 0.81 ACHE (0.47) TSHRACHELMNAMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0624173-B2 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS DOW CHEMICAL CO (US) 2003-04-09 EP disclosed
EP-0624173-B1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS DOW CHEMICAL CO (US) 1997-04-02 EP disclosed
EP-0624173-A1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS. DOW CHEMICAL CO (US) 1994-11-17 EP disclosed
US-5360886-A Alklyphenylphosphine or phosphonium catalyst THE DOW CHEMICAL COMPANY (US) 1994-11-01 US disclosed
US-5310853-A Epoxy resins THE DOW CHEMICAL COMPANY (US) 1994-05-10 US disclosed
WO-1993015126-A1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS THE DOW CHEMICAL COMPANY (US) 1993-08-05 WO disclosed
US-5202407-A Phosphonium or phosphine catalyst having at least three alkylphenyl groups attached to phosphorus atom THE DOW CHEMICAL COMPANY (US) 1993-04-13 US disclosed