Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3354500

C[Si]1(C)C2=Cc3c(ccc4ccccc34)C2[Ti+2]C2C1=Cc1c2ccc2ccccc12.[Cl-].[Cl-]

nearest known ligand 0.35

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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 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
CYP2A6 P11509 3/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HPRT1 P00492 1/20 0.31
CYP1A2 P05177 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 SCHEMBL6437032 0.80 KDM4E (0.36) KDM4ECYP2A6ALDH1A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL3352582 0.75 CHRNB2 (0.31)
Hydrochloric Acid SCHEMBL1686872 0.70 LMNA (0.31)
Hydrochloric Acid SCHEMBL1686826 0.69 ALDH1A1 (0.34) KDM4ECYP2A6ALDH1A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL4063684 0.65 ALDH1A1 (0.39) KDM4ECYP2A6ALDH1A1TSHRHSD17B10
SCHEMBL5609091 0.65 KDM4E (0.41) KDM4ECYP2A6ALDH1A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL7734464 0.65 ALDH1A1 (0.39) KDM4ECYP2A6ALDH1A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL3092658 0.65 ALDH1A1 (0.39) KDM4ECYP2A6ALDH1A1TSHRHSD17B10
SCHEMBL3965890 0.64 ALDH1A1 (0.42) KDM4ECYP2A6ALDH1A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL8853146 0.64 ALDH1A1 (0.38) KDM4ECYP2A6ALDH1A1TSHRHSD17B10

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
US-8410231-B2 Production process of olefin polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-04-02 US disclosed
US-20100029868-A1 PRODUCTION PROCESS OF OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-04 US disclosed