Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7201279

COc1ccc2c(c1)Cc1c-2cc(OC)c(OC)c1[Zr+2].[Cl-].[Cl-]

nearest known ligand 0.46

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
ACHE known ✓ P22303 1/20 0.38
METAP1 P53582 2/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
ABCB1 P08183 2/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41

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 SCHEMBL7201109 0.84 METAP1 (0.45) METAP1CA1CA2CA4CA6
Hydrochloric Acid SCHEMBL27478129 0.80 METAP1 (0.41) METAP1CA1CA2CA4CA6
SCHEMBL7201286 0.78 ABCB1 (0.40) METAP1CA1CA2CA4CA6
SCHEMBL30777630 0.73 METAP1 (0.63) METAP1CA1CA2CA4CA6
SCHEMBL4581239 0.73 METAP1 (0.63) METAP1CA1CA2CA4CA6
SCHEMBL12922754 0.70 METAP1 (0.56) METAP1CA1CA2CA4CA6
SCHEMBL33527391 0.69 CA1 (0.50) METAP1CA1CA2CA4CA6
SCHEMBL26780002 0.69 CA1 (0.50) METAP1CA1CA2CA4CA6
SCHEMBL11384031 0.69 MPO (0.46) METAP1CA1CA2CA4CA6
SCHEMBL6556123 0.68 METAP1 (0.46) METAP1CA1CA2CA4CA6

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-0942006-B1 Catalyst for olefin polymer production and process for olefin polymer production employing the catalyst TOSOH CORP (JP) 2003-06-04 EP disclosed