Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7725653

CC1=Cc2c(ccc3ccccc23)C1[Zr+2](C1C(C)=Cc2c1ccc1ccccc21)=[Ge](C)C.[Cl-].[Cl-]

nearest known ligand 0.34

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 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
CYP2A6 P11509 4/20 0.34
ALDH1A1 P00352 3/20 0.34
TSHR P16473 3/20 0.33
CYP1A2 P05177 2/20 0.33
HSD17B10 Q99714 3/20 0.32
HPGD P15428 2/20 0.32
KDM1A O60341 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
CYP3A4 P08684 2/20 0.30
MAPK1 P28482 1/20 0.30
CASP1 P29466 1/20 0.30
RAB9A P51151 1/20 0.30
CASP7 P55210 1/20 0.30
ATM Q13315 1/20 0.30
HIF1A Q16665 1/20 0.30
L3MBTL1 Q9Y468 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 SCHEMBL7933120 0.86 KDM4E (0.32) KDM4ECYP2A6ALDH1A1HSD17B10HPGD
Hydrochloric Acid SCHEMBL7938953 0.85 KDM4E (0.33) KDM4ECYP2A6ALDH1A1TSHRCYP1A2
Hydrochloric Acid SCHEMBL6466483 0.82 ALDH1A1 (0.36) KDM4ECYP2A6ALDH1A1TSHRCYP1A2
Hydrochloric Acid SCHEMBL7936754 0.82 KDM4E (0.38) KDM4EALDH1A1
Hydrochloric Acid SCHEMBL7926450 0.82 KDM4E (0.33) KDM4E
Hydrochloric Acid SCHEMBL338847 0.79 KDM4E (0.37) KDM4ECYP2A6ALDH1A1TSHRCYP1A2
Hydrochloric Acid SCHEMBL7217830 0.79 KDM4E (0.34) KDM4ECYP2A6ALDH1A1TSHRCYP1A2
Hydrochloric Acid SCHEMBL247996 0.79 KDM4E (0.34) KDM4ECYP2A6ALDH1A1TSHRCYP1A2
Hydrochloric Acid SCHEMBL19520611 0.79 KDM4E (0.34) KDM4ECYP2A6ALDH1A1TSHRCYP1A2
Hydrochloric Acid SCHEMBL6463028 0.79 KDM4E (0.34) KDM4ECYP2A6ALDH1A1TSHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420501-B1 POLYMERIZATION CATALYST ON SUPPORT CHISSO CORPORATION (JP) 2002-07-16 US disclosed
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
EP-1026177-A1 SUPPORTED METALLOCENE CATALYST, PROCESS FOR PREPARING THE SAME, AND PROCESS FOR PRODUCING OLEFIN POLYMERS CHISSO CORPORATION (JP) 2000-08-09 EP disclosed