Hydrochloric Acid

Hydrochloric Acid

SCHEMBL651332

CC1=C(C)[C@@H]([Zr+2]2([C@H]3C(C)=C(C)c4ccccc43)CC2)c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.33

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 6)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.32
GPR3 P46089 1/20 0.31
HTR2C P28335 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
BCHE P06276 1/20 0.30

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 SCHEMBL650587 1.00 ACHE (0.32) ACHEGPR3HTR2CCYP1A2CYP2D6
Hydrochloric Acid SCHEMBL153468 0.80 CYP1A2 (0.41) ACHEGPR3CYP1A2CYP2D6BCHE
Fluoride Ion SCHEMBL1130361 0.76 CYP1A2 (0.45) ACHEGPR3CYP1A2CYP2D6BCHE
Hydrochloric Acid SCHEMBL2118017 0.75 CNR1 (0.35)
Hydrochloric Acid SCHEMBL5952377 0.72 HTR1A (0.30)
Hydrochloric Acid SCHEMBL6433415 0.71 DRD2 (0.32) GPR3CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL5951962 0.71 HPGD (0.33) CYP1A2
SCHEMBL27602853 0.70 GPR3 (0.37) ACHEGPR3
Hydrochloric Acid SCHEMBL7192527 0.69 SLC6A4 (0.32) ACHEGPR3CYP1A2CYP2D6BCHE
Hydrochloric Acid SCHEMBL4079003 0.68 GPR3 (0.35) GPR3

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-8119850-B2 Process for producing unsaturated hydrocarbon compound IDEMITSU KOSAN CO., LTD. (JP) 2012-02-21 US disclosed
US-20090030255-A1 PROCESS FOR PRODUCING UNSATURATED HYDROCARBON COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2009-01-29 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-20090030255-A1 PROCESS FOR PRODUCING UNSATURATED HYDROCARBON COMPOUND ALOX12, ALOX15B, ALOX15 ACHE 3810/4885GPR3 2942/4885HTR2C 1344/4885

“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.