Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3495487

Cc1ccc2c(c1)c1c(n2C)-c2ccccc2C1C1=C([Zr+2])CC=C1.[Cl-].[Cl-]

nearest known ligand 0.36

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 16)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.30
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NR1I2 O75469 1/20 0.36
AHR P35869 1/20 0.36
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
GAA P10253 1/20 0.32
NTRK1 P04629 1/20 0.31
BCHE P06276 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
HSD17B10 Q99714 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 SCHEMBL7634794 0.88 NTRK1 (0.33) NTRK1
SCHEMBL26439497 0.75 KMT2A (0.39) MEN1KMT2ANR1I2AHRKDM4E
Hydrochloric Acid SCHEMBL7128453 0.73 GPR3 (0.32) NTRK1
Hydrochloric Acid SCHEMBL3170692 0.71 HTR2A (0.34)
Hydrochloric Acid SCHEMBL1899672 0.71 MEN1 (0.34) MEN1KMT2ANR1I2AHRKDM4E
SCHEMBL17842624 0.71 MEN1 (0.42) MEN1KMT2ANR1I2AHRKDM4E
Hydrochloric Acid SCHEMBL1899675 0.70 MEN1 (0.35) MEN1KMT2ANR1I2AHRKDM4E
Methane SCHEMBL8935403 0.70 HTR2A (0.33)
Hydrochloric Acid SCHEMBL3483059 0.69 MEN1 (0.34) MEN1KMT2ANR1I2AHRKDM4E
Hydrochloric Acid SCHEMBL7129103 0.68 SLC6A2 (0.32)

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
US-7829641-B2 Process for the preparation of multimodal polyethylene resins EQUISTAR CHEMICALS, LP (US) 2010-11-09 US claimed