Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5601276

CC1=Cc2c(cc(-c3ccc(C)cc3)cc2-n2cccn2)[C@@H]1[Zr+2]([C@H]1C(C)=Cc2c1cc(-c1ccc(C)cc1)cc2-n1cccn1)=[Si](C)C.[Cl-].[Cl-]

nearest known ligand 0.31

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 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
G6PD P11413 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 SCHEMBL5602357 0.84
Hydrochloric Acid SCHEMBL5603694 0.82 GRM5 (0.31) MEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL5604034 0.81
Hydrochloric Acid SCHEMBL5602368 0.81 KMT2A (0.31) MEN1KMT2A
Hydrochloric Acid SCHEMBL5601997 0.81 NPC1 (0.38) MEN1ALDH1A1MAPTKMT2AKDM4E
Hydrochloric Acid SCHEMBL5602836 0.79
Hydrochloric Acid SCHEMBL5603868 0.77 DRD2 (0.34)
Hydrochloric Acid SCHEMBL5603790 0.77
Hydrochloric Acid SCHEMBL5603017 0.77 P2RX4 (0.32)
Hydrochloric Acid SCHEMBL5603295 0.74 MAPT (0.31) ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed