Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28067678

NC(=O)C[n+]1ccccc1N.[Cl-]

nearest known ligand 0.59

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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 19)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.35
KMT2A Q03164 8/20 0.59
MEN1 O00255 6/20 0.59
KDM4E B2RXH2 5/20 0.59
ALDH1A1 P00352 4/20 0.59
APOBEC3A P31941 2/20 0.59
APOBEC3G Q9HC16 2/20 0.59
HPGD P15428 1/20 0.59
USP2 O75604 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
LMNA P02545 1/20 0.36
RAB9A P51151 1/20 0.35
HSP90AA1 P07900 2/20 0.34
POLB P06746 1/20 0.34
IKBKB O14920 1/20 0.33
HTT P42858 1/20 0.33
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL6621776 0.78 KMT2A (0.56) KMT2AMEN1KDM4EALDH1A1APOBEC3A
Hydrochloric Acid SCHEMBL1520305 0.78 MEN1 (0.93) KMT2AMEN1KDM4EALDH1A1APOBEC3A
SCHEMBL6621773 0.77 KMT2A (0.54) KMT2AMEN1KDM4EALDH1A1APOBEC3A
SCHEMBL12766418 0.76 MEN1 (0.96) KMT2AMEN1KDM4EALDH1A1APOBEC3A
SCHEMBL9332188 0.73 ALDH1A1 (0.50) KMT2AMEN1KDM4EALDH1A1APOBEC3A
SCHEMBL9332200 0.73 KMT2A (0.50) KMT2AMEN1KDM4EALDH1A1APOBEC3A
Bromide SCHEMBL893233 0.73 ERAP1 (0.49) KMT2AMEN1KDM4EALDH1A1APOBEC3A
Hydrochloric Acid SCHEMBL11541165 0.72 POLB (0.36) KMT2AMEN1KDM4EALDH1A1APOBEC3A
SCHEMBL18541275 0.72 KDM4E (0.46) KMT2AMEN1KDM4EALDH1A1APOBEC3A
SCHEMBL8303157 0.72 ALDH1A1 (0.44) KMT2AMEN1KDM4EALDH1A1APOBEC3A

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
CN-103619914-B Organopolysiloxane elastomers and utilization thereof 道康宁东丽株式会社 2016-09-07 CN disclosed
CN-103608384-B Liquid organopolysiloxane and use thereof 道康宁东丽株式会社 2016-08-31 CN disclosed