Hydrochloric Acid

Hydrochloric Acid

SCHEMBL601325

N#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 14)

geneUniProtsupporting neighboursconfidence
▸ PTPN5 P54829 2/20 0.36
▸ ACP3 P15309 1/20 0.34
▸ MMP2 P08253 3/20 0.33
▸ MMP9 P14780 2/20 0.31
▸ MMP12 P39900 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ABCB1 P08183 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ABCG2 Q9UNQ0 1/20 0.30
▸ HDAC8 Q9BY41 1/20 0.30
▸ HDAC6 Q9UBN7 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 0.86 ACP3 (0.40) ACP3MMP2MMP9MMP12
Hydrochloric Acid SCHEMBL602954 0.84 ACP3 (0.36) PTPN5ACP3MMP2MMP9MMP12
Hydrochloric Acid SCHEMBL193315 0.84 ACP3 (0.36) PTPN5ACP3MMP2MMP9MMP12
Hydrochloric Acid SCHEMBL602853 0.81 RAB9A (0.36) ACP3MEN1NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL604657 0.81 MMP2 (0.38) ACP3MMP2MMP9MMP12
SCHEMBL3788644 0.80 RAB9A (0.37) ACP3MEN1NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL193413 0.78 MMP2 (0.37) ACP3MMP2MMP9MMP12
Hydrochloric Acid SCHEMBL193049 0.77 ACP3 (0.39) ACP3MMP2MMP9MMP12MEN1
Hydrochloric Acid SCHEMBL2260403 0.77 PTPN5 (0.35) PTPN5MEN1NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL600629 0.76 ACP3 (0.38) ACP3MMP2MMP9MMP12MEN1

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 4 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
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