Hydrochloric Acid

Hydrochloric Acid

SCHEMBL17866205

CC1=C(C)C(C)(C)C([Ti+2]Oc2c(C(C)(C)C)cc(C)cc2C(C)(C)C)=C1C.[Cl-].[Cl-]

nearest known ligand 0.33

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 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CA2 P00918 1/20 0.33
POLB P06746 1/20 0.33
TYR P14679 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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 SCHEMBL392238 0.72
Hydrochloric Acid SCHEMBL17836014 0.68 ALDH1A1 (0.33) ALDH1A1CA2POLBTYRSMN1; SMN2
Hydrochloric Acid SCHEMBL394796 0.68 TSHR (0.31) CA2
Hydrochloric Acid SCHEMBL4461086 0.67 CA4 (0.30)
Hydrochloric Acid SCHEMBL4359909 0.66
Hydrochloric Acid SCHEMBL3154711 0.66 ALDH1A1 (0.34) ALDH1A1CA2POLBTYRSMN1; SMN2
Hydrochloric Acid SCHEMBL714251 0.65 GABRA1 (0.33) CA2
Hydrochloric Acid SCHEMBL3615425 0.65 MEN1 (0.33) SMN1; SMN2
SCHEMBL27800581 0.64 SMN1; SMN2 (0.56) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL2868170 0.64 SMN1; SMN2 (0.50) ALDH1A1CA2POLBTYRSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3034545-B1 A PROCESS FOR THE PREPARATION OF A GRAFT COPOLYMER COMPRISING A POLYOLEFIN MAIN CHAIN AND ONE OR A MULTIPLE POLYMER SIDE CHAINS AND THE PRODUCTS OBTAINED THEREFROM SABIC GLOBAL TECHNOLOGIES BV (NL) 2020-11-04 EP disclosed
EP-3037438-A1 Process for the preparation of a branched polyolefin SABIC Global Technologies B.V. (NL) 2016-06-29 EP disclosed