Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8776359

CC(C)=[Ti+2]c1c(C2=CC=CC2)ccc2c1Cc1ccccc1-2.[Cl-].[Cl-]

nearest known ligand 0.37

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
SLC6A2 known ✓ P23975 1/20 0.32
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
PGR P06401 1/20 0.34
PNMT P11086 1/20 0.33
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32
HTR2B P41595 2/20 0.32
CYP1A2 P05177 1/20 0.32
ADRA2A P08913 1/20 0.32
MAOA P21397 1/20 0.32
HTR2C P28335 1/20 0.32
SLC6A4 P31645 1/20 0.32
SRD5A2 P31213 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 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 SCHEMBL4447246 0.80 DRD2 (0.38) NPC1RAB9APGRPNMTDRD2
Hydrochloric Acid SCHEMBL27425148 0.78 PNMT (0.42) NPC1RAB9APGRPNMTDRD2
SCHEMBL27348144 0.77 PNMT (0.45) NPC1RAB9APGRPNMTDRD2
Hydrochloric Acid SCHEMBL8776346 0.77 NPC1 (0.37) NPC1RAB9APGRPNMTDRD2
Hydrochloric Acid SCHEMBL617844 0.77 NPC1 (0.37) NPC1RAB9APGRPNMTDRD2
Hydrochloric Acid SCHEMBL8776350 0.77 NPC1 (0.37) NPC1RAB9APGRPNMTDRD2
Hydrochloric Acid SCHEMBL7913247 0.77 PNMT (0.36) NPC1RAB9APGRPNMTDRD2
Hydrochloric Acid SCHEMBL27650656 0.77 PNMT (0.36) NPC1RAB9APGRPNMTDRD2
SCHEMBL698266 0.76 NPC1 (0.39) NPC1RAB9APGRPNMTHTR2B
SCHEMBL28220071 0.76 PNMT (0.44) NPC1RAB9APGRPNMTDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628574-B1 Olefin polymerization catalyst and olefin polymerization process TOSOH CORP (JP) 1997-12-03 EP disclosed
EP-0628574-A1 Olefin polymerization catalyst and olefin polymerization process TOSOH CORPORATION (JP) 1994-12-14 EP disclosed