Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7936733

CC1=Cc2c(-c3ccccc3Cl)cccc2C1[Zr+2].[Cl-].[Cl-]

nearest known ligand 0.35

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
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
PLA2G7 Q13093 1/20 0.35
HSD11B1 P28845 3/20 0.34
PTPRC P08575 1/20 0.33
CYP2A6 P11509 1/20 0.32
DPP4 P27487 1/20 0.32
HTR1A P08908 2/20 0.31
HTR7 P34969 2/20 0.31
ALDH1A1 P00352 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
GAA P10253 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
NPSR1 Q6W5P4 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 SCHEMBL5684935 0.86 CRHR1 (0.39) KMT2AHSD11B1ALDH1A1NPSR1
Hydrochloric Acid SCHEMBL27476745 0.84 HTR7 (0.32) HTR7SMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL27513158 0.81 PDCD1 (0.33) ALDH1A1
Hydrochloric Acid SCHEMBL5709184 0.81 PDCD1 (0.35) CYP2A6HTR1AHTR7ALDH1A1
Hydrochloric Acid SCHEMBL29424591 0.81 PDCD1 (0.35) CYP2A6HTR1AHTR7ALDH1A1
Hydrochloric Acid SCHEMBL3163965 0.81 PDCD1 (0.35) CYP2A6HTR1AHTR7ALDH1A1
Hydrochloric Acid SCHEMBL27513161 0.80 NPC1 (0.35) KMT2AHTR1AHTR7SMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL4060835 0.80 ALDH1A1 (0.35) CYP2A6HTR1AHTR7ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL27670358 0.79 GABRA1 (0.31) ALDH1A1
Hydrochloric Acid SCHEMBL27493783 0.79

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
US-20010014718-A1 RESIN COMPOSITIONS AND USE OF THE SAME MITSUI CHEMICALS, INC. (JP) 2001-08-16 US disclosed
CN-1217685-A VULCANIZED MOLDING HAVING SURFACE DECORATIVE LAYER, PAINTED THERMOPLASTIC RESIN COMPOSITION AND PAINTED ELASTOMER COMPOSITION MITSUI CHEMICALS INC (JP) 1999-05-26 CN disclosed
CN-1216055-A RUBBER COMPOSITIONS FOR TIRES MITSUI CHEMICALS INC (JP) 1999-05-05 CN disclosed