Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8460741

CC(C)=C1C=CC=C1[Ti+2]c1[nH]c2ccccc2c1C.[Cl-].[Cl-]

nearest known ligand 0.39

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
AHR P35869 1/20 0.39
DAO P14920 1/20 0.37
DDO Q99489 1/20 0.37
RAB9A P51151 2/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
ALDH1A1 P00352 6/20 0.33
HTT P42858 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 4/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
NPSR1 Q6W5P4 3/20 0.31
KMT2A Q03164 2/20 0.31
MITF O75030 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 3/20 0.31
HPGD P15428 3/20 0.31
USP2 O75604 1/20 0.31
GPR3 P46089 1/20 0.31

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 SCHEMBL8462906 0.83 KIF11 (0.32) HPGDKIF11
Hydrochloric Acid SCHEMBL8464190 0.83
Hydrochloric Acid SCHEMBL8461145 0.81 AHR (0.41) AHRDAODDORAB9ACYP11B1
Hydrochloric Acid SCHEMBL8463368 0.78 AHR (0.39) AHRDAODDORAB9ACYP11B1
Hydrochloric Acid SCHEMBL8461657 0.72 AHR (0.38) AHRDAODDORAB9ACYP11B1
Hydrochloric Acid SCHEMBL8458812 0.72 AHR (0.38) AHRDAODDORAB9ACYP11B1
Hydrochloric Acid SCHEMBL8459498 0.69 AHR (0.43) AHRDAODDORAB9ACYP11B1
Hydrochloric Acid SCHEMBL8462799 0.67
Hydrochloric Acid SCHEMBL8463464 0.64 GABRP (0.30) GABRPGABRDGABRA1GABRB1GABRG2
Hydrochloric Acid SCHEMBL8462744 0.64 KIF11 (0.33) ALDH1A1HSD17B10HPGDGPR3KIF11

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-0741145-B1 Olefin polymerization catalyst and process for producing polyolefin using the same SUMITOMO CHEMICAL CO (JP) 1999-12-29 EP disclosed
EP-0741145-A1 Olefin polymerization catalyst and process for producing polyolefin using the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-11-06 EP disclosed