Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5565982

CC[n+]1cccc(Nc2ccc(C)c(O)c2)c1.[Cl-]

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
▸ ALDH1A1 P00352 2/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ KDR P35968 7/20 0.39
▸ HSD17B2 P37059 2/20 0.39
▸ MAPT P10636 1/20 0.38
▸ EGFR P00533 5/20 0.36
▸ LMNA P02545 1/20 0.35
▸ FLT1 P17948 1/20 0.34
▸ FLT4 P35916 1/20 0.34
▸ TUBB4A P04350 1/20 0.33
▸ TUBB P07437 1/20 0.33
▸ TUBA3C P0DPH7 1/20 0.33
▸ TUBA1B P68363 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 SCHEMBL5566059 0.84 LMNA (0.44) ALDH1A1CYP1A2CYP2D6KDRHSD17B2
Hydrochloric Acid SCHEMBL5565999 0.81 KDR (0.41) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL6130226 0.80 TUBB4A (0.47) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL5564793 0.80 KDR (0.40) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
Iodide SCHEMBL5565778 0.78 KDR (0.41) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL5566063 0.76 KDR (0.40) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL7555415 0.73 HPGD (0.54) ALDH1A1MEN1CYP3A4GAAKMT2A
SCHEMBL5561195 0.70 HSD17B2 (0.38) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL17508259 0.68 TDP1 (0.56) ALDH1A1MEN1CYP3A4GAAKMT2A
Hydrochloric Acid SCHEMBL6130211 0.68 TUBB4A (0.45) ALDH1A1MAPTLMNATUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229479-B2 Method of coloring porous material CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-06-12 — — US disclosed
US-20060162095-A1 Method of colouring porous material CIBA SPECIALTY CHEMICALS CORP. 2006-07-27 — — US disclosed
EP-1534226-A1 METHOD OF COLOURING POROUS MATERIAL Ciba SC Holding AG (CH) 2005-06-01 — — EP disclosed
WO-2004019897-A1 METHOD OF COLOURING POROUS MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-03-11 — — 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-20060162095-A1 Method of colouring porous material ACR, HLA-C, TYR ALDH1A1 2989/4885CYP1A2 2502/4885CYP2D6 1859/4885

“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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