Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7182233

CC(=Nc1c(C)cc(C)cc1C)c1cccc(C(C)=Nc2c(C)cc(C)cc2C)n1.[Cl-].[Cl-].[Cl-].[Fe+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
PAX8 Q06710 1/20 0.35
HSP90AA1 P07900 3/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ATM Q13315 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 3/20 0.33
CYP1A2 P05177 3/20 0.32
CYP2A6 P11509 1/20 0.32
HKDC1 Q2TB90 2/20 0.32
PLAU P00749 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
NFKB1 P19838 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 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 SCHEMBL811295 0.97 PAX8 (0.35) PAX8HSP90AA1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL7175041 0.97 PAX8 (0.35) PAX8HSP90AA1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL7176154 0.97 PAX8 (0.35) PAX8HSP90AA1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL7174397 0.97 PAX8 (0.35) PAX8HSP90AA1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL5693547 0.97 PAX8 (0.35) PAX8HSP90AA1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL7177207 0.97 PAX8 (0.35) PAX8HSP90AA1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL817480 0.97 PAX8 (0.35) PAX8HSP90AA1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL7185143 0.97 PAX8 (0.35) PAX8HSP90AA1MEN1KMT2AATM
SCHEMBL453477 0.97 HSP90AA1 (0.36) PAX8HSP90AA1MEN1KMT2AATM
SCHEMBL453478 0.97 HSP90AA1 (0.36) PAX8HSP90AA1MEN1KMT2AATM

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