Hydrochloric Acid

Hydrochloric Acid

SCHEMBL16236349

CCCCC(=O)Oc1ccc2ccccc2c1-c1c(O[Ti+3])ccc2ccccc12.[Cl-].[Cl-].[Cl-]

nearest known ligand 0.64

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
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
RECQL P46063 1/20 0.48
NCEH1 Q6PIU2 4/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 2/20 0.42
GLA P06280 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
POLM Q9NP87 1/20 0.42
POLK Q9UBT6 1/20 0.42
POLL Q9UGP5 1/20 0.42
POLH Q9Y253 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40
PTGS2 P35354 1/20 0.40
CYP2C9 P11712 1/20 0.39

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
SCHEMBL16236476 0.92 KMT2A (0.55) KMT2AKDM4EMEN1RECQLNCEH1
SCHEMBL16236078 0.90 MAPT (0.58) KMT2AKDM4EMEN1RECQLNCEH1
SCHEMBL16236776 0.87 KMT2A (0.50) KMT2AKDM4EMEN1RECQLNCEH1
SCHEMBL16236148 0.86 MEN1 (0.49) KMT2AKDM4EMEN1RECQLNCEH1
Hydrochloric Acid SCHEMBL16236186 0.85 KMT2A (0.46) KMT2AKDM4EMEN1RECQLNCEH1
SCHEMBL16236790 0.84 KMT2A (0.47) KMT2AKDM4EMEN1RECQLNCEH1
SCHEMBL16236412 0.84 KDM4E (0.47) KMT2AKDM4EMEN1RECQLNCEH1
SCHEMBL16236333 0.84 KMT2A (0.50) KMT2AKDM4EMEN1RECQLNCEH1
SCHEMBL16236469 0.83 LMNA (0.60) KMT2AKDM4EMEN1RECQLNCEH1
SCHEMBL30448350 0.80 MAPT (0.45) KMT2AKDM4EMEN1RECQLNCEH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2997050-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2018-01-17 EP disclosed
US-9714303-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2017-07-25 US disclosed
US-20160115261-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia, s.r.l. (IT) 2016-04-28 US disclosed
EP-2997050-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2016-03-23 EP disclosed
WO-2014184171-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2014-11-20 WO disclosed
EP-2803678-A1 Catalyst components for the polymerization of olefins Basell Poliolefine Italia S.r.l. (IT) 2014-11-19 EP disclosed