Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28655715

CC1=Cc2c(ccc(C)c2-c2ccccc2)C1[Zr+2]C1C(c2ccc(C)o2)=Cc2c1ccc(C)c2-c1ccccc1.[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 6)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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 SCHEMBL30312708 0.95 PTGS1 (0.39) PTGS1PTGS2MEN1KMT2AADORA2A
Hydrochloric Acid SCHEMBL28329694 0.89 PTGS1 (0.34) PTGS1PTGS2MEN1KMT2A
Hydrochloric Acid SCHEMBL28329691 0.88 PTGS1 (0.34) PTGS1PTGS2MEN1KMT2AADORA2A
Hydrochloric Acid SCHEMBL28670211 0.88 ADORA2A (0.34) PTGS1PTGS2ADORA2AADORA1
Hydrochloric Acid SCHEMBL28878396 0.83
Hydrochloric Acid SCHEMBL28660133 0.82 PTGS1 (0.30) PTGS1PTGS2
Hydrochloric Acid SCHEMBL30557801 0.82 PTGS1 (0.37) PTGS1PTGS2MEN1KMT2A
Hydrochloric Acid SCHEMBL28668206 0.80 PTGS1 (0.39) PTGS1PTGS2MEN1KMT2AADORA2A
Hydrochloric Acid SCHEMBL6903716 0.80 PTGS1 (0.34) PTGS1PTGS2MEN1KMT2AADORA2A
SCHEMBL28678581 0.80 PTGS1 (0.37) PTGS1PTGS2MEN1KMT2AADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113631591-B Process for producing catalyst component for olefin polymerization, process for producing catalyst for olefin polymerization, and process for producing olefin polymer 日本聚丙烯株式会社 2023-05-05 CN disclosed
CN-110483670-B Metallocene complex and process for producing olefin polymer 日本聚丙烯株式会社 2021-11-30 CN disclosed