Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5003776

Fc1ccccc1CC1C([Cr+2])=C(Cc2ccccn2)c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.34

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
CHRM2 known ✓ P08172 1/20 0.33
CHRM1 known ✓ P11229 1/20 0.33
CHRM3 known ✓ P20309 1/20 0.33
CHRNA7 P36544 1/20 0.34
ALDH1A1 P00352 5/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
RAB9A P51151 2/20 0.33
TNKS2 Q9H2K2 1/20 0.33
NPC1 O15118 1/20 0.33
HTT P42858 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
HRH1 P35367 1/20 0.32
P2RX7 Q99572 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PPIA P62937 1/20 0.31
MEN1 O00255 1/20 0.31
PKM P14618 1/20 0.31
KMT2A Q03164 1/20 0.31

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 SCHEMBL5000189 0.76 MAPT (0.39) ALDH1A1TAAR1KDM4EMEN1KMT2A
SCHEMBL5004055 0.75 HTR6 (0.38) CHRNA7ALDH1A1L3MBTL1RAB9ATNKS2
SCHEMBL9953712 0.72 L3MBTL1 (0.50) ALDH1A1L3MBTL1RAB9ANPC1HTT
SCHEMBL5004387 0.70 HTR6 (0.38) CHRNA7ALDH1A1L3MBTL1RAB9ATNKS2
SCHEMBL9731494 0.67 HTR2A (0.45) ALDH1A1HRH1MEN1PKMKMT2A
Hydrochloric Acid SCHEMBL5003513 0.65 ALDH1A1 (0.35) ALDH1A1RAB9ANPC1MEN1PKM
Hydrochloric Acid SCHEMBL5003774 0.65 CHRNA7 (0.36) CHRNA7ALDH1A1L3MBTL1RAB9ANPC1
SCHEMBL28343693 0.63 L3MBTL1 (0.53) ALDH1A1L3MBTL1HRH1TAAR1
SCHEMBL6378358 0.62 HRH1 (0.44) CHRNA7ALDH1A1L3MBTL1RAB9ANPC1
SCHEMBL29830938 0.61 L3MBTL1 (0.59) ALDH1A1L3MBTL1HRH1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1824888-B1 MONOCYCLOPENTADIENYL COMPLEXES BASELL POLYOLEFINE GMBH (DE) 2017-01-18 EP disclosed
US-20080269445-A1 Monocyclopentadienyl Complexes BASELL POLYOLEFINE GMBH (DE) 2008-10-30 US disclosed
EP-1824888-A1 MONOCYCLOPENTADIENYL COMPLEXES Basell Polyolefine GmbH (DE) 2007-08-29 EP disclosed
WO-2006063826-A1 MONOCYCLOPENTADIENYL COMPLEXES BASELL POLYOLEFINE GMBH (DE) 2006-06-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269445-A1 Monocyclopentadienyl Complexes PCBP1, COASY, PORCN CHRM2 3986/4885CHRM1 3194/4885CHRM3 2988/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.