Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2849490

C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.Cc1cc(C)c(-n2c(Br)c(Br)n(-c3c(C)cc(C)cc3C)c2=[Ru+2])c(C)c1.[Cl-].[Cl-]

nearest known ligand 0.32

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 15)

geneUniProtsupporting neighboursconfidence
CHRM1 known ✓ P11229 1/20 0.30
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TAS1R3 Q7RTX0 2/20 0.30
TAS1R1 Q7RTX1 2/20 0.30
TAS1R2 Q8TE23 2/20 0.30
NR1I2 O75469 1/20 0.30
KDM4B O94953 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 1/20 0.30
DOHH Q9BU89 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 SCHEMBL6444703 0.80 ALDH1A1 (0.33) ALDH1A1POLBMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL2961475 0.77 MAPT (0.36) ALDH1A1POLBMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL1277163 0.77
Hydrochloric Acid SCHEMBL2148761 0.74
Hydrochloric Acid SCHEMBL2123059 0.73 GAA (0.31)
SCHEMBL15388072 0.73
Hydrochloric Acid SCHEMBL5274126 0.70 TAS1R3 (0.31) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL16834202 0.70 ALDH1A1 (0.34) ALDH1A1POLBMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL919913 0.69 CRHR1 (0.34)
SCHEMBL17459753 0.69 ALDH1A1 (0.33) ALDH1A1POLBMAPTHTTSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140087136-A1 RESIN COMPOSITION AND SEMICONDUCTOR DEVICE BOARD ZEON CORPORATION (JP) 2014-03-27 US disclosed
US-20100144924-A1 POLYMERIZABLE COMPOSITION ZEON CORPORATION (JP) 2010-06-10 US disclosed
US-20080234422-A1 Norbornene-Based Resin Molded Article and Method of Production Thereof RIMTEC CORPORATION (JP) 2008-09-25 US disclosed