Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7183205

Cc1cnc(-c2cccc(-c3ncc(C)n3C)n2)n1C.[Cl-].[Cl-].[Cl-].[Nd+3]

nearest known ligand 0.38

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
BDKRB2 known ✓ P30411 1/20 0.34
ACHE known ✓ P22303 1/20 0.31
KDM4E B2RXH2 3/20 0.38
TP53 P04637 2/20 0.38
CCR1 P32246 2/20 0.38
CCR8 P51685 2/20 0.38
LMNA P02545 2/20 0.38
MAPK1 P28482 2/20 0.38
HTT P42858 2/20 0.38
ALPL P05186 1/20 0.38
HSP90AA1 P07900 1/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38
ALOX15 P16050 1/20 0.38
CCR5 P51681 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RAB9A P51151 3/20 0.36
NPC1 O15118 3/20 0.36

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 SCHEMBL7171654 0.96 KDM4E (0.38) KDM4ETP53CCR1CCR8LMNA
Hydrochloric Acid SCHEMBL7181352 0.96 TP53 (0.38) KDM4ETP53CCR1CCR8LMNA
Hydrochloric Acid SCHEMBL7175992 0.96 KDM4E (0.38) KDM4ETP53CCR1CCR8LMNA
Hydrochloric Acid SCHEMBL7179144 0.96 KDM4E (0.38) KDM4ETP53CCR1CCR8LMNA
Hydrochloric Acid SCHEMBL7171297 0.96 KDM4E (0.38) KDM4ETP53CCR1CCR8LMNA
Hydrochloric Acid SCHEMBL7177150 0.96 KDM4E (0.38) KDM4ETP53CCR1CCR8LMNA
SCHEMBL21893772 0.81 NPC1 (0.48) KDM4ETP53CCR1CCR8LMNA
Hydrochloric Acid SCHEMBL7182832 0.75 LMNA (0.40) KDM4ELMNAMAPK1SMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL7173377 0.72 LMNA (0.40) KDM4ELMNAMAPK1SMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL7182723 0.72 LMNA (0.40) KDM4ELMNAMAPK1SMN1; SMN2RAB9A

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
EP-1367069-A1 Process for homo-or copolymerization of conjugated diens DOW GLOBAL TECHNOLOGIES INC. (US) 2003-12-03 EP disclosed