Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7926518

CCC1=C(c2cccc3ccccc23)c2ccccc2C1[Hf+2](C1C(CC)=C(c2cccc3ccccc23)c2ccccc21)=[Ge](C)C.[Cl-].[Cl-]

nearest known ligand 0.32

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 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.32
KDM1A O60341 1/20 0.31
SLC6A4 P31645 4/20 0.31
DRD2 P14416 1/20 0.31
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HTR2C P28335 2/20 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 SCHEMBL7933100 0.83 KDM1A (0.33) KDM1AALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL7936601 0.82 SLC6A4 (0.33) KDM1ASLC6A4DRD2ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL7933117 0.81 ALOX5 (0.35) KDM1AALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL7936175 0.77 KDM1A (0.31) KDM1ASLC6A4DRD2ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL8603782 0.73 SLC6A4 (0.34) KDM1ASLC6A4DRD2ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL8604890 0.73 SLC6A4 (0.36) KDM1ASLC6A4DRD2ALDH1A1HTR2C
Hydrochloric Acid SCHEMBL5604466 0.72 SLC6A4 (0.33) KDM1ASLC6A4DRD2ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL5146591 0.70 SLC6A4 (0.34) ALOX15SLC6A4DRD2ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL7584293 0.70 SLC6A4 (0.34) KDM1ASLC6A4DRD2ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL6371618 0.70 SLC6A4 (0.34) ALOX15SLC6A4DRD2ALDH1A1L3MBTL1

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-6184402-B1 RESOLUTION OF A STEREOISOMERIC MIXTURE OF SPECIFIC METALLOCENE COMPLEXES BRIDGED WITH A TRANSITION METAL HAVING AN OXYGEN BOND ATTACHED, I.E., A MU-OXO COMPLEX; HYDROLYSIS IN THE PRESENCE OF A BASE; SEPARATION OF MESO FORM FROM MIXES CHISSO CORPORATION (JP) 2001-02-06 US disclosed