Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9167609

CCCCCCCCCCCCOc1cc(CC(=O)Nc2cccc(-c3scc[n+]3C)c2)ccc1Cl.[Cl-]

nearest known ligand 0.41

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
P2RY14 Q15391 1/20 0.41
FBP1 P09467 2/20 0.41
RORC P51449 2/20 0.40
LMNA P02545 7/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
HTT P42858 4/20 0.39
KMT2A Q03164 4/20 0.39
PTGER1 P34995 1/20 0.39
TP53 P04637 3/20 0.39
TSHR P16473 3/20 0.39
MAPK1 P28482 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
HSD17B10 Q99714 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 3/20 0.39
MAPT P10636 2/20 0.39
EPHX2 P34913 1/20 0.38
HPGD P15428 1/20 0.38
XBP1 P17861 1/20 0.38
HTR1E P28566 1/20 0.38

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 SCHEMBL9159480 0.91 P2RY14 (0.40) P2RY14FBP1RORCLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL9163416 0.91 MAPT (0.40) RORCLMNASMN1; SMN2MAPK1ALDH1A1
Hydrochloric Acid SCHEMBL9164860 0.90 SMN1; SMN2 (0.50) P2RY14FBP1LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL9161558 0.89 P2RY14 (0.40) P2RY14FBP1LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL9163469 0.88 P2RY14 (0.41) P2RY14FBP1LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL9165654 0.88 PTPN11 (0.42) P2RY14FBP1LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL9168443 0.88 PTPN11 (0.42) P2RY14FBP1LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL9164136 0.87 P2RY14 (0.54) P2RY14LMNASMN1; SMN2HTTALDH1A1
Hydrochloric Acid SCHEMBL9161430 0.87 P2RY14 (0.54) P2RY14LMNASMN1; SMN2HTTALDH1A1
Hydrochloric Acid SCHEMBL9166966 0.87 P2RY14 (0.40) P2RY14LMNASMN1; SMN2HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5432189-A Bis-aryl amide and urea antagonists of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1995-07-11 US disclosed
US-5350759-A Bis-aryl urea compounds WISSNER ALLAN (US) 1994-09-27 US disclosed
US-5231182-A Platelet activating factor inhibitor AMERICAN CYANAMID COMPANY (US) 1993-07-27 US disclosed
US-5225425-A Respiratory system disorders AMERICAN CYANAMID COMPANY (US) 1993-07-06 US disclosed
US-5128351-A BIS-ARYL AMIDE AND UREA ANTAGONISTS OF PLATELET ACTIVATING FACTOR AMERICAN CYANAMID COMPANY (US) 1992-07-07 US disclosed
US-5077409-A Reducing hydroxy bis-aryl amide, acylating, hydrolyzing, sulfonating, halogenating, alkylating with nitrogen heterocycle AMERICAN CYANAMID COMPANY (US) 1991-12-31 US disclosed