Hydrochloric Acid

Hydrochloric Acid

SCHEMBL19372017

CCc1nc2ccccc2o1.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]c1nc2ccccc2o1

nearest known ligand 0.56

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
RAB9A P51151 4/20 0.56
MAPT P10636 3/20 0.56
NPC1 O15118 3/20 0.56
TP53 P04637 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 2/20 0.51
LOXL2 Q9Y4K0 1/20 0.50
HTT P42858 1/20 0.44
GFER P55789 1/20 0.44
USP2 O75604 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39

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 SCHEMBL2147139 0.88 RAB9A (0.66) RAB9AMAPTNPC1TP53SMN1; SMN2
Hydrochloric Acid SCHEMBL2147609 0.88 RAB9A (0.66) RAB9AMAPTNPC1TP53SMN1; SMN2
Hydrochloric Acid SCHEMBL2147012 0.88 RAB9A (0.66) RAB9AMAPTNPC1TP53SMN1; SMN2
SCHEMBL2621291 0.88 MAPT (0.70) RAB9AMAPTNPC1TP53SMN1; SMN2
SCHEMBL31276462 0.88 MAPT (0.70) RAB9AMAPTNPC1TP53SMN1; SMN2
Bromide SCHEMBL9239377 0.86 MAPT (0.68) RAB9AMAPTNPC1TP53SMN1; SMN2
Ethane SCHEMBL2147606 0.84 MAPT (0.48) RAB9AMAPTNPC1TP53SMN1; SMN2
Hydrochloric Acid SCHEMBL19372018 0.81 RAB9A (0.56) RAB9AMAPTNPC1TP53SMN1; SMN2
Acetic Acid SCHEMBL9270113 0.79 NPC1 (0.58) RAB9AMAPTNPC1TP53SMN1; SMN2
SCHEMBL31276277 0.74 MAPT (0.78) RAB9AMAPTNPC1TP53SMN1; SMN2

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-2526129-B1 ETHYLENE POLYMERISATION PROCESS SAUDI BASIC IND CORP (SABIC) (SA) 2017-09-27 EP disclosed