Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5852941

CC1=C(C)C(C)C([Ti+2](NC(=O)c2cc(C)cc(C)c2)[SiH](c2ccccc2)c2ccccc2)=C1C.[Cl-].[Cl-]

nearest known ligand 0.36

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
POLB P06746 4/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
PDPK1 O15530 1/20 0.33
AKT1 P31749 1/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
THRB P10828 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
MAPT P10636 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
GAA P10253 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 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 SCHEMBL5853468 0.92 SMN1; SMN2 (0.46) POLBSMN1; SMN2MEN1KMT2AKCNK3
Hydrochloric Acid SCHEMBL5854289 0.90 SMN1; SMN2 (0.35) POLBSMN1; SMN2MEN1KMT2AKCNK3
Hydrochloric Acid SCHEMBL5853668 0.89 KMT2A (0.36) SMN1; SMN2KMT2ATAS1R3TAS1R1TAS1R2
Hydrochloric Acid SCHEMBL5854321 0.85 L3MBTL1 (0.34) KDM4ETAS1R3TAS1R1TAS1R2GAA
Hydrochloric Acid SCHEMBL5853269 0.84 SMN1; SMN2 (0.30) SMN1; SMN2
Hydrochloric Acid SCHEMBL5856109 0.84 HPGD (0.39) POLBSMN1; SMN2KCNK3KCNK9GAA
Hydrochloric Acid SCHEMBL5855501 0.84 NR1H4 (0.41) SMN1; SMN2MEN1KMT2AKCNK3KCNK9
Hydrochloric Acid SCHEMBL5856054 0.83 TAS1R3 (0.36) POLBTHRBTAS1R3TAS1R1TAS1R2
Hydrochloric Acid SCHEMBL5855094 0.82 LMNA (0.35) KMT2AKCNK3KCNK9
Hydrochloric Acid SCHEMBL5854586 0.81

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