Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7124703

Cc1cc2c(n1-c1ccccc1)C([Zr+2]C1c3ccccc3-c3cc(C)n(-c4ccccc4)c31)c1ccccc1-2.[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 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.36
SMN1; SMN2 Q16637 7/20 0.36
MAPT P10636 7/20 0.36
RAB9A P51151 6/20 0.36
MEN1 O00255 6/20 0.36
KMT2A Q03164 6/20 0.36
NPC1 O15118 5/20 0.36
TP53 P04637 3/20 0.36
LMNA P02545 3/20 0.36
TSHR P16473 2/20 0.36
MITF O75030 1/20 0.36
PLA2G1B P04054 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
NOTUM Q6P988 1/20 0.36
HTT P42858 3/20 0.34
CYP1A2 P05177 3/20 0.34
KDM4E B2RXH2 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
CYP2C9 P11712 2/20 0.34

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 SCHEMBL7120044 0.80 GPR3 (0.34) ALDH1A1SMN1; SMN2MAPTGPR3
Hydrochloric Acid SCHEMBL7117815 0.71 L3MBTL1 (0.44) ALDH1A1MAPTMEN1KMT2ALMNA
Ethane SCHEMBL8163438 0.69 GPR3 (0.44) MEN1KMT2ALMNATSHRCYP1A2
SCHEMBL8702175 0.69 GPR3 (0.44) MEN1KMT2ALMNATSHRCYP1A2
Hydrochloric Acid SCHEMBL618216 0.69 GPR3 (0.42) MEN1KMT2ATSHRCYP1A2POLB
Hydrochloric Acid SCHEMBL5355296 0.67 ELANE (0.42) ALDH1A1SMN1; SMN2RAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL8599251 0.67 GPR3 (0.41) MEN1KMT2ATSHRCYP1A2POLB
Hydrochloric Acid SCHEMBL8378993 0.67 GPR3 (0.41) MEN1KMT2ATSHRCYP1A2POLB
Hydrochloric Acid SCHEMBL7119556 0.67 GPR3 (0.36) GPR3
Ethylene SCHEMBL6914332 0.65 GPR3 (0.39) MEN1KMT2ATSHRCYP1A2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030148877-A1 Metallocenes and catalysts for olefin-polymerisation BASELL TECHNOLOGY COMPANY BV (NL) 2003-08-07 US disclosed
EP-0952978-B1 METALLOCENES AND CATALYSTS FOR OLEFIN-POLYMERISATION BASELL POLYOLEFINE GMBH (DE) 2003-01-22 EP disclosed
US-6451724-B1 BIS(N-METHYL-5,10-DIHYDROINDENO(1,2-B)INDOL-10 -YL)TITANIUM DICHLORIDE BASELL TECHNOLOGY COMPANY BV (NL) 2002-09-17 US disclosed
EP-0952978-A1 METALLOCENES AND CATALYSTS FOR OLEFIN-POLYMERISATION Montell Technology Company bv (NL) 1999-11-03 EP disclosed
WO-1999024446-A1 METALLOCENES AND CATALYSTS FOR OLEFIN-POLYMERISATION MONTELL TECHNOLOGY COMPANY B.V. (NL) 1999-05-20 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-20030148877-A1 Metallocenes and catalysts for olefin-polymerisation MT-CO1, CPNE4, MT-CO3 ALDH1A1 2373/4885SMN1; SMN2 2543/4885MAPT 4246/4885

“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.