Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7123312

Cn1c2c(c3ccccc31)-c1ccccc1C2[Zr+2]1(C2c3ccccc3-c3c2n(C)c2ccccc32)CC1.[Cl-].[Cl-]

nearest known ligand 0.37

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
GPR3 P46089 1/20 0.37
NTRK1 P04629 2/20 0.35
CYP3A4 P08684 2/20 0.34
KCNH2 Q12809 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
HTR3E A5X5Y0 1/20 0.34
SLC22A2 O15244 1/20 0.34
SLC22A1 O15245 1/20 0.34
SLC22A3 O75751 1/20 0.34
HTR3B O95264 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
HTR2B P41595 1/20 0.34
CHRNA4 P43681 1/20 0.34
HTR3A P46098 1/20 0.34
HTR3D Q70Z44 1/20 0.34
SLC47A2 Q86VL8 1/20 0.34
HTR3C Q8WXA8 1/20 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 SCHEMBL7126498 0.82 L3MBTL1 (0.41) KDM4EMAPTL3MBTL1
Hydrochloric Acid SCHEMBL7126873 0.75 GPR3 (0.40) GPR3NTRK1HTR2AHTR2CCDC25A
SCHEMBL7195665 0.75 GPR3 (0.40) GPR3NTRK1HTR2AHTR2CCDC25A
Hydrochloric Acid SCHEMBL7117726 0.75 GPR3 (0.40) GPR3NTRK1HTR2AHTR2CNPY1R
Hydrochloric Acid SCHEMBL7125639 0.75 GPR3 (0.40) GPR3NTRK1HTR2AHTR2CCDC25A
SCHEMBL7638144 0.74 GPR3 (0.41) GPR3NTRK1HTR2AHTR2CCDC25A
SCHEMBL7124307 0.74 GPR3 (0.41) GPR3NTRK1HTR2AHTR2CCDC25A
SCHEMBL7126885 0.74 GPR3 (0.41) GPR3NTRK1HTR2AHTR2CCDC25A
SCHEMBL7125690 0.73 GPR3 (0.38) GPR3NTRK1CDC25ACDC25CKDM4E
Hydrochloric Acid SCHEMBL7119543 0.73 NTRK1 (0.38) GPR3NTRK1HTR2AHTR2CCDC25A

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 GPR3 3696/4885NTRK1 3468/4885CYP3A4 1495/4885

“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.