Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8079657

Cc1cc(C)c2c(c1)C([Zr+2]C1C(c3ccccc3)=Cc3c(C)cc(C)cc31)C(c1ccccc1)=C2.[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 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
ALDH1A1 P00352 3/20 0.33
RAB9A P51151 2/20 0.33
PSMB5 P28074 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
RECQL P46063 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 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
SCHEMBL27449307 0.79 LMNA (0.33) LMNASMN1; SMN2MCOLN3ALDH1A1RAB9A
Hydrochloric Acid SCHEMBL8078727 0.76 KDM4E (0.33) ALDH1A1RAB9AKDM4EMAPTMEN1
SCHEMBL8079661 0.76 LMNA (0.34) LMNASMN1; SMN2MCOLN3PSMB5
Hydrochloric Acid SCHEMBL8080008 0.76 KDM4E (0.32) ALDH1A1RAB9AKDM4EMAPTMEN1
Hydrochloric Acid SCHEMBL29612264 0.74 UGT2B17 (0.31)
Hydrochloric Acid SCHEMBL7641761 0.74 UGT2B17 (0.31)
Hydrochloric Acid SCHEMBL6290297 0.71 TACR1 (0.33)
Hydrochloric Acid SCHEMBL1681583 0.71 CYP11B1 (0.34) ALDH1A1
Hydrochloric Acid SCHEMBL7937385 0.71 CYP11B1 (0.34) ALDH1A1
Hydrochloric Acid SCHEMBL6287243 0.70 CYP11B1 (0.32) LMNASMN1; SMN2ALDH1A1RAB9AKDM4E

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
EP-0745099-B1 REACTOR BLEND POLYPROPYLENE AND PROCESS FOR THE PREPARATION THEREOF MONTELL TECHNOLOGY COMPANY BV (NL) 2000-09-13 EP disclosed
US-6107431-A CATALYTIC POLYMERIZATION OF POLYPROPYLENE THERMOPLASTIC ELASTOMER USING ALUMOXANE-METALLOCENE DERIVATIVE CATALYST MONTELL TECHNOLOGY COMPANY BV (NL) 2000-08-22 US disclosed
US-5747621-A CATALYTIC ADDITION POLYMERIZATION MONTELL TECHNOLOGY COMPANY BV (NL) 1998-05-05 US disclosed
EP-0745099-A1 REACTOR BLEND POLYPROPYLENE, PROCESS FOR THE PREPARATION THEREOF AND PROCESS FOR PREPARING METALLOCENE LIGANDS Montell Technology Company bv (NL) 1996-12-04 EP disclosed
WO-1996020225-A2 REACTOR BLEND POLYPROPYLENE, PROCESS FOR THE PREPARATION THEREOF AND PROCESS FOR PREPARING METALLOCENE LIGANDS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1996-07-04 WO disclosed