Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5604466

CCC1=C(c2cccc3ccccc23)c2ccccc2C1[Zr+2](C1C(CC)=C(c2cccc3ccccc23)c2ccccc21)=[Si](C)C.[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 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.32
SLC6A3 known ✓ Q01959 1/20 0.32
SLC6A4 P31645 5/20 0.33
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM1A O60341 1/20 0.31
MTNR1A P48039 1/20 0.31
MTNR1B P49286 1/20 0.31
DRD2 P14416 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 SCHEMBL5604484 0.86 NPC1 (0.31) SLC6A4SLC6A2SLC6A3MAPT
Hydrochloric Acid SCHEMBL339001 0.83 KDM4E (0.33) SLC6A4SLC6A2SLC6A3ALDH1A1MEN1
Hydrochloric Acid SCHEMBL3759506 0.83 KDM4E (0.33) SLC6A4SLC6A2SLC6A3ALDH1A1MEN1
Hydrochloric Acid SCHEMBL7936175 0.82 KDM1A (0.31) SLC6A4ALDH1A1KDM1ADRD2L3MBTL1
Hydrochloric Acid SCHEMBL3275850 0.81 SLC6A4 (0.32) SLC6A4DRD2
Hydrochloric Acid SCHEMBL7936151 0.80 NPC1 (0.33) SLC6A4MAPTKDM1AMTNR1AMTNR1B
Hydrochloric Acid SCHEMBL7936601 0.77 SLC6A4 (0.33) SLC6A4SLC6A2SLC6A3ALDH1A1MEN1
Hydrochloric Acid SCHEMBL31126400 0.75 SLC6A4 (0.32) SLC6A4SLC6A2SLC6A3ALDH1A1MEN1
Hydrochloric Acid SCHEMBL6903687 0.75 SLC6A4 (0.32) SLC6A4SLC6A2SLC6A3ALDH1A1MEN1
Hydrochloric Acid SCHEMBL5950993 0.75 ALDH1A1 (0.32) ALDH1A1MEN1MAPTHPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7160949-B2 Olefin block copolymers, processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-01-09 US disclosed
EP-1275670-B1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF MITSUI CHEMICALS INC (JP) 2005-08-10 EP disclosed
US-20030055179-A1 Olefin block copolymers processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2003-03-20 US disclosed
EP-1275670-A1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2003-01-15 EP 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