Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5006798

[Cl-].[Cl-].[Cr+2]C1=C(Cc2ccccc2)C(c2cccc3cccnc23)c2c1ccc1ccccc21

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
PAX8 Q06710 1/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CCR1 P32246 2/20 0.36
CCR8 P51685 2/20 0.36
KDM4E B2RXH2 2/20 0.36
GMNN O75496 1/20 0.36
TP53 P04637 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MMP2 P08253 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MMP9 P14780 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
NFKB1 P19838 1/20 0.36
MMP8 P22894 1/20 0.36
THPO P40225 1/20 0.36
MTOR P42345 1/20 0.36

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 SCHEMBL5009057 0.83 P2RX7 (0.40) PAX8MAPTLMNASMN1; SMN2CCR1
Hydrochloric Acid SCHEMBL819992 0.81 KDM4E (0.38) MAPTLMNASMN1; SMN2CCR1CCR8
Hydrochloric Acid SCHEMBL1069659 0.80 CCR1 (0.40) MAPTLMNASMN1; SMN2CCR1CCR8
Hydrochloric Acid SCHEMBL3078672 0.72 CCR1 (0.36) MAPTLMNASMN1; SMN2CCR1CCR8
Hydrochloric Acid SCHEMBL1074386 0.70 LMNA (0.39) MAPTLMNASMN1; SMN2CCR1CCR8
Hydrochloric Acid SCHEMBL1071824 0.69 MAPT (0.40) MAPTLMNASMN1; SMN2CCR1CCR8
SCHEMBL28517555 0.66 KDM4E (0.54) MAPTLMNASMN1; SMN2CCR1CCR8
Phenanthrene SCHEMBL16685315 0.65 CCR1 (0.76) MAPTLMNASMN1; SMN2CCR1CCR8
Hydrochloric Acid SCHEMBL819577 0.65 KDM4E (0.41) MAPTLMNASMN1; SMN2CCR1CCR8
Hydrochloric Acid SCHEMBL1071469 0.64 SMN1; SMN2 (0.43) MAPTLMNASMN1; SMN2CCR1CCR8

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
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

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 PAX8 3735/4885MAPT 1887/4885LMNA 2672/4885

“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.