Hydrochloric Acid

Hydrochloric Acid

SCHEMBL25169296

COc1ccc(-c2cnc3c(Nc4ccc(C(=O)N[C@H]5C[C@@H](NC(=O)C[N+](C)(C)C)C5)c(C)c4)nccn23)c(F)c1F.[Cl-]

nearest known ligand 0.43

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 9)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 13/20 0.43
▸ AXL P30530 2/20 0.37
▸ PTK2 Q05397 1/20 0.36
▸ SYK P43405 2/20 0.35
▸ MAP3K7 O43318 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ TAB1 Q15750 1/20 0.35
▸ PTK6 Q13882 1/20 0.35

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
SCHEMBL25450828 1.00 TTK (0.43) TTKAXLPTK2SYKMAP3K7
Hydrochloric Acid SCHEMBL25169297 1.00 TTK (0.43) TTKAXLPTK2SYKMAP3K7
Hydrochloric Acid SCHEMBL25176133 0.96 TTK (0.48) TTKAXLPTK2
Hydrochloric Acid SCHEMBL25170303 0.96 TTK (0.48) TTKAXLPTK2
SCHEMBL25450817 0.96 TTK (0.48) TTKAXLPTK2
SCHEMBL24112481 0.96 TTK (0.48) TTKAXLPTK2
Hydrochloric Acid SCHEMBL25170305 0.96 TTK (0.48) TTKAXLPTK2
SCHEMBL24112085 0.90 TTK (0.45) TTKAXLPTK2SYKPTK6
Formic Acid SCHEMBL25176068 0.90 PTK6 (0.40) TTKAXLPTK6
SCHEMBL24940111 0.89 TTK (0.45) TTKAXLPTK2SYKPTK6

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-20230141600-A1 IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — 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-20230141600-A1 IMIDAZOPYRAZINE DERIVATIVES IKZF3, RRP15, IK TTK 4336/4885AXL 1164/4885PTK2 3799/4885

“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.

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