Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4387634

CC(C)(C)c1ccc2ccc3ccc(C(C)(C)C)nc3c2n1.[Cl-].[Cl-].[Pd+2]

nearest known ligand 0.40

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
CCR1 P32246 5/20 0.40
CCR5 P51681 2/20 0.40
RAB9A P51151 1/20 0.40
KDM4E B2RXH2 2/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GMNN O75496 1/20 0.33
TP53 P04637 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MMP2 P08253 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MMP9 P14780 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33

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
Bromide SCHEMBL4393343 0.95 CCR1 (0.40) CCR1CCR5RAB9AKDM4ELMNA
Iodide SCHEMBL4381098 0.95 CCR1 (0.40) CCR1CCR5RAB9AKDM4ELMNA
SCHEMBL4585013 0.95 CCR1 (0.43) CCR1CCR5RAB9AKDM4ELMNA
SCHEMBL4585864 0.92 CCR1 (0.42) CCR1CCR5RAB9AKDM4ELMNA
SCHEMBL30492698 0.83 LMNA (0.61) CCR1CCR5KDM4ELMNAMAPT
SCHEMBL14082010 0.83 LMNA (0.61) CCR1CCR5KDM4ELMNAMAPT
SCHEMBL29769214 0.83 LMNA (0.61) CCR1CCR5KDM4ELMNAMAPT
SCHEMBL14884090 0.83 CCR1 (0.33) CCR1CCR5RAB9AKDM4ELMNA
SCHEMBL10032260 0.81 SMN1; SMN2 (0.36) CCR1CCR5RAB9AKDM4EMAPT
SCHEMBL23456655 0.79 CCR1 (0.32) CCR1CCR5RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181948-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-07-16 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-20090181948-A1 DIAMINE DERIVATIVE ARG1, PRMT5, PRMT1 CCR1 1870/4885CCR5 2925/4885RAB9A 289/4885

“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.