Hydrochloric Acid

Hydrochloric Acid

SCHEMBL21980376

C=C(C)C.Cc1ccc(C2=Cc3ccccc3C2[Zr+2]C2C(c3ccc(C)c4ccccc34)=Cc3ccccc32)c2ccccc12.[Cl-].[Cl-]

nearest known ligand 0.35

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 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.35

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
SCHEMBL7996884 0.77 CYP1A2 (0.42) CYP1A2
Hydrochloric Acid SCHEMBL7198818 0.76 TNKS2 (0.32)
Hydrochloric Acid SCHEMBL21980355 0.76 ALDH1A1 (0.31)
Hydrochloric Acid SCHEMBL6898339 0.76 CYP1A2 (0.41) CYP1A2
SCHEMBL7252931 0.75 CYP1A2 (0.43) CYP1A2
Hydrochloric Acid SCHEMBL6287696 0.74 PTPN1 (0.35)
SCHEMBL7645586 0.73 CYP1A2 (0.41) CYP1A2
Hydrochloric Acid SCHEMBL8426784 0.71 CYP1A2 (0.40) CYP1A2
SCHEMBL2233259 0.69 CYP1A2 (0.36) CYP1A2
Hydrochloric Acid SCHEMBL6287243 0.68 CYP11B1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3660133-B1 POLYALPHAOLEFIN HAVING UNIFORM STRUCTURE AND METHOD OF PREPARING SAME DL CHEMICAL CO LTD (KR) 2022-03-23 EP disclosed
US-11180583-B2 Polyalphaolefin having uniform structure and method of preparing same DL CHEMICAL CO., LTD. (KR) 2021-11-23 US disclosed
EP-3660133-A1 POLYALPHAOLEFIN HAVING UNIFORM STRUCTURE AND METHOD OF PREPARING SAME Daelim Industrial Co., Ltd. (KR) 2020-06-03 EP disclosed
US-20200165362-A1 POLYALPHAOLEFIN HAVING UNIFORM STRUCTURE AND METHOD OF PREPARING SAME DAELIM INDUSTRIAL CO., LTD. (KR) 2020-05-28 US disclosed