Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4090480

CNc1ccnc(OCC(F)(F)F)c1.[Cl-].[H+]

nearest known ligand 0.42

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
EPHX2 P34913 1/20 0.42
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
LMNA P02545 4/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
SORT1 Q99523 1/20 0.36
CFTR P13569 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HDAC4 P56524 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CYP17A1 P05093 2/20 0.33
MAPT P10636 3/20 0.33
PAX8 Q06710 2/20 0.33
HTT P42858 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
S1PR2 O95136 1/20 0.33
S1PR4 O95977 1/20 0.33
GAA P10253 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
Hydrochloric Acid SCHEMBL4090481 0.97 EPHX2 (0.42) EPHX2MEN1KMT2ALMNAL3MBTL1
SCHEMBL5330498 0.78 ACACB (0.38) LMNASMN1; SMN2HTTGAA
Hydrochloric Acid SCHEMBL29072728 0.77 RAF1 (0.37) EPHX2MEN1KMT2AL3MBTL1SORT1
SCHEMBL109903 0.76 ALDH1A1 (0.48) EPHX2MEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL10174370 0.76 RXRA (0.44) EPHX2MEN1KMT2AL3MBTL1SMN1; SMN2
Hydrochloric Acid SCHEMBL30939095 0.75 LOXL2 (0.38) EPHX2MEN1KMT2ALMNAL3MBTL1
SCHEMBL4182663 0.74 MAPT (0.46) EPHX2MEN1KMT2ALMNAL3MBTL1
SCHEMBL19497540 0.73 EPHX2 (0.41) EPHX2MEN1KMT2ALMNAL3MBTL1
SCHEMBL22621570 0.73 CCR1 (0.48) EPHX2LMNAL3MBTL1TDP1SMN1; SMN2
SCHEMBL28012488 0.73 L3MBTL1 (0.51) EPHX2MEN1KMT2ALMNAL3MBTL1

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
US-8247430-B2 Substituted aryl-amine derivatives and methods of use AMGEN INC. (US) 2012-08-21 US disclosed
US-20090143355-A1 Substituted aryl-amine derivatives and methods of use AMGEN INC. (US) 2009-06-04 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-20090143355-A1 Substituted aryl-amine derivatives and methods of use FLT1, FLT4, NAT1 EPHX2 334/4885MEN1 1555/4885KMT2A 1075/4885

“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.