Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7203977

CCC1=C(c2ccccc2)C([Zr+2]C2C(c3ccccc3)=C(CC)c3ccccc32)c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.37

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
ESR1 P03372 3/20 0.37
ESR2 Q92731 2/20 0.37
ADRB2 P07550 1/20 0.33
CYP19A1 P11511 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
HTR7 P34969 1/20 0.31

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 SCHEMBL7199527 0.78 ADRA2A (0.32)
Hydrochloric Acid SCHEMBL6928905 0.78 ADRA2A (0.32)
Hydrochloric Acid SCHEMBL7202409 0.69 NPC1 (0.34)
Ethane SCHEMBL8163438 0.68 GPR3 (0.44) CYP19A1
Hydrochloric Acid SCHEMBL7199222 0.68 BCHE (0.32)
Hydrochloric Acid SCHEMBL27479364 0.68 PDCD1 (0.32) ADRB2
Hydrochloric Acid SCHEMBL618216 0.68 GPR3 (0.42) CYP19A1
Hydrochloric Acid SCHEMBL8378993 0.66 GPR3 (0.41) CYP19A1
Hydrochloric Acid SCHEMBL8599251 0.66 GPR3 (0.41) CYP19A1
Hydrochloric Acid SCHEMBL5352100 0.66 ALDH1A1 (0.46)

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
EP-0776909-B1 HIGH DENSITY ETHYLENE POLYMER AND METHOD FOR PRODUCING THE SAME ASAHI CHEMICAL IND (JP) 2003-11-19 EP disclosed
US-5973083-A HIGH IMPACT RESISTANCE AND HIGH STIFFNESS, EXCELLENT MOLDABILITY, HIGH MELT FLOWABILITY ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1999-10-26 US disclosed
EP-0776909-A1 HIGH-DENSITY ETHYLENIC POLYMER AND PROCESS FOR PRODUCING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1997-06-04 EP disclosed