Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9715398

CCCCCCCCCCCC[N+]1=C(C)N(Cc2ccccc2)CC1.[Cl-]

nearest known ligand 0.61

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
EEF2K O00418 2/20 0.61
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.38
KCNH2 Q12809 1/20 0.37
DNM1 Q05193 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37
CYP2C19 P33261 1/20 0.37
DRD3 P35462 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP19A1 P11511 3/20 0.36

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
SCHEMBL6397498 0.81 EEF2K (0.47) EEF2KMEN1KMT2ALMNACYP1A2
Hydrochloric Acid SCHEMBL11780574 0.80 EEF2K (0.62) EEF2KMEN1KMT2ASMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL11780426 0.78 EEF2K (0.95) EEF2KMEN1KMT2ATP53MAPK1
Hydrochloric Acid SCHEMBL11786436 0.78 EEF2K (0.59) EEF2KMEN1KMT2AMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL7775450 0.78 EEF2K (0.59) EEF2KMEN1KMT2AMAPK1SMN1; SMN2
Water SCHEMBL11786512 0.77 EEF2K (0.62) EEF2KMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL7776941 0.76 EEF2K (0.61) EEF2KMEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL11783733 0.76 EEF2K (0.95) EEF2KMEN1KMT2ATP53MAPK1
Hydrochloric Acid SCHEMBL11784271 0.74 EEF2K (0.43) EEF2KHTT
Hydrochloric Acid SCHEMBL11783365 0.73 EEF2K (0.51) EEF2KMEN1KMT2AALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0500712-A1 COMBATTING SLIME-FORMING MICROORGANISMS Henkel Kommanditgesellschaft auf Aktien (DE) 1992-09-02 EP disclosed
WO-1991007090-A1 COMBATTING SLIME-FORMING MICROORGANISMS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1991-05-30 WO disclosed
US-3931129-A FLUOROELASTOMER COMPOSITION DAIKIN KOGYO CO., LTD. (JA) 1976-01-06 US disclosed