Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6938925

COc1cccc(N(O)C(=O)C[n+]2ccccc2)c1.[Cl-]

nearest known ligand 0.50

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 9)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.50
MTNR1A P48039 10/20 0.46
MTNR1B P49286 10/20 0.46
PKM P14618 1/20 0.46
BACE1 P56817 1/20 0.46
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL6942054 0.99 HSP90AA1 (0.48) HSP90AA1MTNR1AMTNR1BPKMBACE1
Hydrochloric Acid SCHEMBL6943412 0.82 POLB (0.47) HSP90AA1PKMBACE1POLBKMT2A
Hydrochloric Acid SCHEMBL6941349 0.82 POLB (0.47) HSP90AA1PKMBACE1POLBKMT2A
Hydrochloric Acid SCHEMBL6573026 0.81 MTNR1B (0.40) MTNR1AMTNR1BPOLBKMT2A
SCHEMBL6941713 0.81 POLB (0.45) HSP90AA1PKMBACE1POLBKMT2A
SCHEMBL6939459 0.81 POLB (0.45) HSP90AA1PKMBACE1POLBKMT2A
SCHEMBL6572944 0.80 MTNR1B (0.40) MTNR1AMTNR1BPOLBKMT2A
Hydrochloric Acid SCHEMBL6942158 0.80 PABPC1 (0.47) HSP90AA1BACE1POLBKMT2ASMN1; SMN2
SCHEMBL6944437 0.78 HSP90AA1 (0.47) HSP90AA1POLBKMT2ASMN1; SMN2
SCHEMBL6944265 0.78 PABPC1 (0.48) HSP90AA1BACE1POLBKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066022-B1 COMPOSITIONS FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC COUPLER, NOVEL CATIONIC COUPLERS, THEIR USE FOR OXIDATION DYEING AND DYEING METHODS OREAL (FR) 2003-10-22 EP claimed
US-6544298-B1 Dyeing human hair using coupler L'OREAL (FR) 2003-04-08 US claimed
US-6537329-B1 Intense colorations with a wide range of colours, excellent colorfastness L'OREAL S.A. (FR) 2003-03-25 US claimed
US-6544298-B1 Dyeing human hair using coupler L'OREAL (FR) 2003-04-08 US disclosed
US-6537329-B1 Intense colorations with a wide range of colours, excellent colorfastness L'OREAL S.A. (FR) 2003-03-25 US disclosed