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Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8364314

CC1=C(c2ccccc2)C(C2=C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)C([Zr+2])c3ccccc32)c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.37

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 3)

geneUniProtsupporting neighboursconfidence
▸ RXRB P28702 4/20 0.33
▸ RXRA P19793 3/20 0.33
▸ RXRG P48443 2/20 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 SCHEMBL8361917 0.90 TACR1 (0.36) RXRBRXRARXRG
Hydrochloric Acid SCHEMBL8366175 0.90 TACR1 (0.36) RXRBRXRARXRG
Hydrochloric Acid SCHEMBL8364165 0.88 LMNA (0.32) —
Hydrochloric Acid SCHEMBL8364269 0.86 RXRB (0.33) RXRBRXRARXRG
Hydrochloric Acid SCHEMBL8361840 0.86 TACR1 (0.33) RXRBRXRA
Hydrochloric Acid SCHEMBL6924007 0.76 RXRA (0.32) RXRBRXRA
Hydrochloric Acid SCHEMBL8366096 0.76 TACR1 (0.35) RXRBRXRARXRG
Hydrochloric Acid SCHEMBL8364768 0.76 TACR1 (0.35) RXRBRXRARXRG
Hydrochloric Acid SCHEMBL8365950 0.72 LMNA (0.32) —
Hydrochloric Acid SCHEMBL8364207 0.71 TACR1 (0.33) RXRBRXRA

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
WO-1999035171-A1 HIGH-MELTING POLYOLEFIN COPOLYMER ELASTOMERS, CATALYSTS AND METHODS OF SYNTHESIS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JR. UNIVERSITY (US) 1999-07-15 — — WO disclosed