Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8099458

O=c1c2ccccc2nnn1O[O+]=C(N=C1CCCC1)N=C1CCCC1.[Cl-]

nearest known ligand 0.39

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 13)

geneUniProtsupporting neighboursconfidence
HPSE Q9Y251 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 5/20 0.37
HPGD P15428 2/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
HTT P42858 1/20 0.35

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
Perchlorate SCHEMBL8087283 0.94 MEN1 (0.38) HPSEMEN1KMT2AALDH1A1HPGD
Perchlorate SCHEMBL8086953 0.93 MEN1 (0.38) HPSEMEN1KMT2AALDH1A1HPGD
Hydrochloric Acid SCHEMBL8100111 0.74 ALDH1A1 (0.43) HPSEMEN1KMT2AALDH1A1HPGD
SCHEMBL6234424 0.70 HPSE (0.52) HPSEMEN1KMT2AALDH1A1HPGD
Hydrochloric Acid SCHEMBL8095270 0.70 GAA (0.37) MEN1KMT2AALDH1A1HPGDCYP1A2
Hydrochloric Acid SCHEMBL8095522 0.69 GAA (0.36) MEN1KMT2AALDH1A1HPGDCYP1A2
SCHEMBL1561845 0.67 HPSE (0.53) HPSEMEN1KMT2AALDH1A1HPGD
SCHEMBL18493192 0.67 HPSE (0.50) HPSEMEN1KMT2AALDH1A1HPGD
SCHEMBL24437289 0.66 ALDH1A1 (0.51) HPSEMEN1KMT2AALDH1A1HPGD
SCHEMBL757021 0.66 ALDH1A1 (0.56) HPSEMEN1KMT2AALDH1A1HPGD

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
EP-1061904-A1 NANOPARTICLES, METHOD FOR PRODUCING NANOPARTICLES AND USE OF THE SAME Aventis Research & Technologies GmbH & Co KG (DE) 2000-12-27 EP disclosed
WO-1999047130-A1 NANOPARTICLES, METHOD FOR PRODUCING NANOPARTICLES AND USE OF THE SAME AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 1999-09-23 WO disclosed