Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7172136

CCCOCCn1c(-c2cccc(-c3nc4ccccc4n3CCOCCC)n2)nc2ccccc21.[Cl-].[Cl-].[Fe+2]

nearest known ligand 0.57

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 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.57
HSD17B10 Q99714 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.51
ATM Q13315 1/20 0.51
HPGD P15428 3/20 0.50
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.50
ALDH1A1 P00352 4/20 0.47
LMNA P02545 3/20 0.47
TSHR P16473 2/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MYC P01106 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 1/20 0.46
TP53 P04637 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.45

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 SCHEMBL7176527 0.97 KDM4E (0.57) KDM4EHSD17B10L3MBTL1ATMHPGD
Hydrochloric Acid SCHEMBL7175594 0.97 KDM4E (0.57) KDM4EHSD17B10L3MBTL1ATMHPGD
Hydrochloric Acid SCHEMBL7172131 0.97 KDM4E (0.57) KDM4EHSD17B10L3MBTL1ATMHPGD
Hydrochloric Acid SCHEMBL7181171 0.97 KDM4E (0.57) KDM4EHSD17B10L3MBTL1ATMHPGD
Hydrochloric Acid SCHEMBL7181379 0.97 KDM4E (0.57) KDM4EHSD17B10L3MBTL1ATMHPGD
Hydrochloric Acid SCHEMBL7174794 0.97 KDM4E (0.57) KDM4EHSD17B10L3MBTL1ATMHPGD
Hydrochloric Acid SCHEMBL7171611 0.93 KDM4E (0.55) KDM4EHSD17B10L3MBTL1ATMHPGD
Hydrochloric Acid SCHEMBL7183851 0.91 KDM4E (0.70) KDM4EHSD17B10L3MBTL1ATMHPGD
Hydrochloric Acid SCHEMBL7175966 0.90 KDM4E (0.53) KDM4EHSD17B10L3MBTL1ATMHPGD
Hydrochloric Acid SCHEMBL7176681 0.90 KDM4E (0.55) KDM4EHSD17B10L3MBTL1ATMHPGD

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