Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5852827

Cc1cc(C)c(C(=O)N[Ti+2](C2c3ccccc3-c3ccccc32)[SiH](c2ccccc2)c2ccccc2)c(C)c1.[Cl-].[Cl-]

nearest known ligand 0.38

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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 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
PPIA P62937 3/20 0.35
LMNA P02545 3/20 0.35
MEN1 O00255 1/20 0.35
TAS1R3 Q7RTX0 4/20 0.33
TAS1R1 Q7RTX1 4/20 0.33
TAS1R2 Q8TE23 4/20 0.33
TP53 P04637 1/20 0.32
OPRM1 P35372 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31

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 SCHEMBL5853669 0.92 TAS1R3 (0.38) KMT2APPIALMNAMEN1TAS1R3
Hydrochloric Acid SCHEMBL5852780 0.88 MEN1 (0.39) KMT2APPIALMNAMEN1OPRM1
Hydrochloric Acid SCHEMBL5852359 0.87 KMT2A (0.40) KMT2APPIALMNAMEN1TAS1R3
Hydrochloric Acid SCHEMBL5856502 0.85 SMN1; SMN2 (0.48) KMT2ALMNAMEN1OPRM1ALDH1A1
Hydrochloric Acid SCHEMBL5855370 0.83 HPGD (0.40) KMT2AALDH1A1
Hydrochloric Acid SCHEMBL5853726 0.82 MEN1 (0.39) KMT2ALMNAMEN1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL5856454 0.81 LMNA (0.36) KMT2APPIALMNA
Hydrochloric Acid SCHEMBL5853398 0.80 KMT2A (0.35) KMT2ALMNATAS1R3TAS1R1TAS1R2
Hydrochloric Acid SCHEMBL5855558 0.80 POLB (0.37) KMT2APPIALMNAMEN1MAPT
Hydrochloric Acid SCHEMBL5854699 0.78 TAS1R3 (0.40) KMT2APPIALMNAMEN1TAS1R3

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-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed