Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7185535

CC(=Nc1c(C(C)C)cccc1C(C)C)c1cc(Cl)cc(C(C)=Nc2c(C(C)C)cccc2C(C)C)n1.[Cl-].[Cl-].[Co+2]

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
SLC6A2 known ✓ P23975 1/20 0.33
LMNA P02545 2/20 0.35
GABRA1 P14867 3/20 0.35
GABRB1 P18505 2/20 0.35
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
FAAH O00519 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
PTGS1 P23219 1/20 0.33
HTR2C P28335 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
HTR2B P41595 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33

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 SCHEMBL7176110 0.97 LMNA (0.35) LMNAGABRA1GABRB1GABRG2GABRB3
Hydrochloric Acid SCHEMBL7172101 0.97 LMNA (0.35) LMNAGABRA1GABRB1GABRG2GABRB3
Hydrochloric Acid SCHEMBL7179409 0.97 LMNA (0.35) LMNAGABRA1GABRB1GABRG2GABRB3
Hydrochloric Acid SCHEMBL7179033 0.97 LMNA (0.35) LMNAGABRA1GABRB1GABRG2GABRB3
Hydrochloric Acid SCHEMBL7181964 0.97 LMNA (0.35) LMNAGABRA1GABRB1GABRG2GABRB3
Hydrochloric Acid SCHEMBL7175559 0.97 LMNA (0.35) LMNAGABRA1GABRB1GABRG2GABRB3
Hydrochloric Acid SCHEMBL7178078 0.87 GABRA1 (0.35) LMNAGABRA1GABRB1GABRG2GABRB3
Hydrochloric Acid SCHEMBL1575633 0.86 GABRA1 (0.39) LMNAGABRA1GABRB1GABRG2GABRB3
Hydrochloric Acid SCHEMBL7180567 0.86 GABRA1 (0.35) GABRA1GABRB1GABRB2GAA
Hydrochloric Acid SCHEMBL7179117 0.86 GABRA1 (0.35) GABRA1GABRB1

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