Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7203525

Cc1ccc2ccccc2c1C1([Zr+2]C2(c3c(C)ccc4ccccc34)C=Cc3ccccc32)C=Cc2ccccc21.[Cl-].[Cl-]

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
CYP2A6 P11509 3/20 0.38
TSHR P16473 3/20 0.38
CYP1A2 P05177 2/20 0.38
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
CYP2D6 P10635 1/20 0.32
MAPK1 P28482 1/20 0.31
CYP3A4 P08684 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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 SCHEMBL7196058 0.82 KDM4E (0.36) CYP2A6TSHRCYP1A2ALDH1A1MEN1
Hydrochloric Acid SCHEMBL7199522 0.76 OXTR (0.32) TSHR
Hydrochloric Acid SCHEMBL7197153 0.75 HTR2C (0.31)
Hydrochloric Acid SCHEMBL7200948 0.69 LMNA (0.32) LMNA
SCHEMBL7065225 0.69 KDM4E (0.40) CYP2A6TSHRCYP1A2ALDH1A1MEN1
SCHEMBL27439257 0.66 CYP1A2 (0.34) CYP2A6TSHRCYP1A2ALDH1A1MEN1
Hydrochloric Acid SCHEMBL7203972 0.66 CYP2D6 (0.38) CYP2D6
Fluoride Ion SCHEMBL1130161 0.65 LMNA (0.32) LMNA
SCHEMBL7036426 0.63 MEN1 (0.38) CYP2A6CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL12537557 0.62 MEN1 (0.42) CYP2A6TSHRCYP1A2ALDH1A1MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0776909-B1 HIGH DENSITY ETHYLENE POLYMER AND METHOD FOR PRODUCING THE SAME ASAHI CHEMICAL IND (JP) 2003-11-19 EP disclosed
US-5973083-A HIGH IMPACT RESISTANCE AND HIGH STIFFNESS, EXCELLENT MOLDABILITY, HIGH MELT FLOWABILITY ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1999-10-26 US disclosed
EP-0776909-A1 HIGH-DENSITY ETHYLENIC POLYMER AND PROCESS FOR PRODUCING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1997-06-04 EP disclosed