Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7979475

CC1=Cc2c(-c3ccc4cc5ccccc5cc4c3)cccc2C1[Zr+2].[Cl-].[Cl-]

nearest known ligand 0.35

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
SLC6A2 known ✓ P23975 1/20 0.33
SLC6A3 known ✓ Q01959 1/20 0.33
GSTP1 P09211 1/20 0.35
SLC6A4 P31645 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
CTSD P07339 1/20 0.33
BACE1 P56817 1/20 0.33
DHFR P00374 1/20 0.32
ESR2 Q92731 1/20 0.32
MET P08581 1/20 0.31
PIM1 P11309 1/20 0.31
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 1/20 0.30
AKT1 P31749 1/20 0.30
TLR8 Q9NR97 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
KDM4E B2RXH2 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 SCHEMBL7601708 0.96 GSTP1 (0.39) GSTP1SLC6A2SLC6A4SLC6A3HDAC4
Hydrochloric Acid SCHEMBL27512112 0.92 GSTP1 (0.36) GSTP1SLC6A2SLC6A4SLC6A3HDAC4
Hydrochloric Acid SCHEMBL4910747 0.82 ALDH1A1 (0.30) ALDH1A1
Hydrochloric Acid SCHEMBL27495381 0.81 PDCD1 (0.33) ALDH1A1
Hydrochloric Acid SCHEMBL29424591 0.81 PDCD1 (0.35) ALDH1A1
Hydrochloric Acid SCHEMBL5709184 0.81 PDCD1 (0.35) ALDH1A1
Hydrochloric Acid SCHEMBL3163965 0.81 PDCD1 (0.35) ALDH1A1
Hydrochloric Acid SCHEMBL27513160 0.80 FYN (0.35) METPIM1ADORA1NPC1RAB9A
Hydrochloric Acid SCHEMBL6889130 0.80 SYK (0.33) NPC1ALDH1A1MAPTRAB9A
Hydrochloric Acid SCHEMBL27480139 0.80 CES1 (0.37) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1191286-C Ethylene copolymer rubber, process for producing same and use MITSUI CHEMICALS INC (JP) 2005-03-02 CN disclosed
CN-1118511-C Flexible resin composition and its use MITSUI CHEMICALS INC (JP) 2003-08-20 CN disclosed
CN-1344283-A Ethylene copolymer rubber, process for producing the same, and use thereof MITSUI CHEMICALS INC (JP) 2002-04-10 CN disclosed
US-6194501-B1 ALPHA-OLEFIN-VINYLAROMATIC COPOLYMER AND TACKIFIER RESINS MITSUI CHEMICALS INC (JP) 2001-02-27 US disclosed
CN-1281871-A Flexible resin composition and its use MITSUI CHEMICALS INC (JP) 2001-01-31 CN disclosed
CN-1217685-A VULCANIZED MOLDING HAVING SURFACE DECORATIVE LAYER, PAINTED THERMOPLASTIC RESIN COMPOSITION AND PAINTED ELASTOMER COMPOSITION MITSUI CHEMICALS INC (JP) 1999-05-26 CN disclosed
CN-1216053-A SHRINKABLE FILM MADE FROM OLEFINE COPOLYMER MITSUI CHEMICALS INC (JP) 1999-05-05 CN disclosed
CN-1216055-A RUBBER COMPOSITIONS FOR TIRES MITSUI CHEMICALS INC (JP) 1999-05-05 CN disclosed