Hydrochloric Acid

Hydrochloric Acid

SCHEMBL193315

Cc1ccc(-[n+]2ccc(-c3cc[n+](-c4ccccc4CP(=O)(O)O)cc3)cc2)cc1.[Cl-].[Cl-]

nearest known ligand 0.36

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
▸ ACHE known ✓ P22303 1/20 0.35
▸ ACP3 P15309 1/20 0.36
▸ MMP2 P08253 2/20 0.35
▸ MMP9 P14780 2/20 0.35
▸ MMP12 P39900 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ BCHE P06276 1/20 0.35
▸ PGK1 P00558 2/20 0.33
▸ PGK2 P07205 2/20 0.33
▸ PTPN5 P54829 1/20 0.32
▸ TSHR P16473 1/20 0.30
▸ GRIN2D O15399 1/20 0.30
▸ GRIN3B O60391 1/20 0.30
▸ GRIN1 Q05586 1/20 0.30
▸ GRIN2A Q12879 1/20 0.30
▸ GRIN2B Q13224 1/20 0.30
▸ GRIN2C Q14957 1/20 0.30
▸ GRIN3A Q8TCU5 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 SCHEMBL604049 0.89 ACP3 (0.40) ACP3MMP2MMP9MMP12GRIN2D
Hydrochloric Acid SCHEMBL193413 0.89 MMP2 (0.37) ACP3MMP2MMP9MMP12PGK1
Hydrochloric Acid SCHEMBL602954 0.87 ACP3 (0.36) ACP3MMP2MMP9MMP12PTPN5
Hydrochloric Acid SCHEMBL601325 0.84 PTPN5 (0.36) ACP3MMP2MMP9MMP12RAB9A
Hydrochloric Acid SCHEMBL604657 0.84 MMP2 (0.38) ACP3MMP2MMP9MMP12
Hydrochloric Acid SCHEMBL602853 0.84 RAB9A (0.36) ACP3ALDH1A1RAB9A
Hydrochloric Acid SCHEMBL604501 0.82 PGK1 (0.38) ACP3MMP2MMP9MMP12RAB9A
SCHEMBL3788644 0.82 RAB9A (0.37) ACP3ALDH1A1RAB9A
Hydrochloric Acid SCHEMBL603493 0.82 ACP3 (0.39) ACP3MMP2MMP9MMP12PGK1
Hydrochloric Acid SCHEMBL193049 0.80 ACP3 (0.39) ACP3MMP2MMP9MMP12ALDH1A1

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
US-8786932-B2 Advanced electrode structures and electrochromic devices NTERA, INC. (US) 2014-07-22 — — US claimed
US-20120038967-A1 ADVANCED ELECTRODE STRUCTURES AND ELECTROCHROMIC DEVICES NTERA LIMITED (IE) 2012-02-16 — — US claimed
US-8786932-B2 Advanced electrode structures and electrochromic devices NTERA, INC. (US) 2014-07-22 — — US disclosed
US-20120038967-A1 ADVANCED ELECTRODE STRUCTURES AND ELECTROCHROMIC DEVICES NTERA LIMITED (IE) 2012-02-16 — — US disclosed
EP-2401650-A1 ADVANCED ELECTRODE STRUCTURES AND ELECTROCHROMIC DEVICES Ntera, Inc. (US) 2012-01-04 — — EP disclosed
WO-2010099147-A1 ADVANCED ELECTRODE STRUCTURES AND ELECTROCHROMIC DEVICES NTERA INC. (US) 2010-09-02 — — WO disclosed
Send feedback