Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7183137

CCCCc1cc(CCCC)c(N=C(C)c2cccc(C(C)=Nc3c(CCCC)cc(CCCC)cc3CCCC)n2)c(CCCC)c1.[Cl-].[Cl-].[Fe+2]

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 14)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.34
TLR8 Q9NR97 2/20 0.33
MAPK1 P28482 2/20 0.33
RAB9A P51151 2/20 0.33
HTT P42858 2/20 0.33
KCNH2 Q12809 1/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LPL P06858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
TYR P14679 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 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 SCHEMBL7172480 0.97 TRPV1 (0.34) TRPV1TLR8MAPK1RAB9AHTT
Hydrochloric Acid SCHEMBL7176863 0.97 TRPV1 (0.34) TRPV1TLR8MAPK1RAB9AHTT
Hydrochloric Acid SCHEMBL7177457 0.97 TRPV1 (0.34) TRPV1TLR8MAPK1RAB9AHTT
Hydrochloric Acid SCHEMBL7178920 0.97 TRPV1 (0.34) TRPV1TLR8MAPK1RAB9AHTT
Hydrochloric Acid SCHEMBL7178223 0.97 TRPV1 (0.34) TRPV1TLR8MAPK1RAB9AHTT
Hydrochloric Acid SCHEMBL7171420 0.97 TRPV1 (0.34) TRPV1TLR8MAPK1RAB9AHTT
Hydrochloric Acid SCHEMBL7183693 0.90 TLR8 (0.33) TRPV1TLR8MAPK1RAB9AHTT
Hydrochloric Acid SCHEMBL7178976 0.89 GRIN2D (0.32)
Hydrochloric Acid SCHEMBL7177253 0.89 KCNH2 (0.37) TRPV1TLR8RAB9AHTTKCNH2
Hydrochloric Acid SCHEMBL7178990 0.87 TLR8 (0.33) TRPV1TLR8MAPK1RAB9AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1367069-A1 Process for homo-or copolymerization of conjugated diens DOW GLOBAL TECHNOLOGIES INC. (US) 2003-12-03 EP disclosed