Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5855077

CC1=C(C)C(C)C([Zr+2](NC(=O)c2ccccc2)[SiH](C)C)=C1C.[Cl-].[Cl-]

nearest known ligand 0.34

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
NAMPT known ✓ P43490 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
HPGD P15428 3/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
LMNA P02545 2/20 0.33
HDAC3 O15379 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
IDO1 P14902 1/20 0.33
ALOX15 P16050 1/20 0.33
HDAC1 Q13547 1/20 0.33
CA9 Q16790 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33

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 SCHEMBL5852724 0.84 TAS1R3 (0.35) POLBGAA
Hydrochloric Acid SCHEMBL5854974 0.82 KCNK3 (0.36) CYP3A4CYP2C19LMNAALDH1A1GAA
Hydrochloric Acid SCHEMBL5853681 0.81 ITGB1 (0.31) LMNAGAA
Hydrochloric Acid SCHEMBL9568471 0.79 SMN1; SMN2 (0.34) SMN1; SMN2NPC1RAB9AHPGDPOLB
Hydrochloric Acid SCHEMBL5855906 0.79 SMN1; SMN2 (0.44) SMN1; SMN2NPC1RAB9APOLBMAPT
Hydrochloric Acid SCHEMBL5853795 0.75
Hydrochloric Acid SCHEMBL5853572 0.74 HPGD (0.39) SMN1; SMN2NPC1RAB9AHPGDPOLB
Hydrochloric Acid SCHEMBL5855091 0.72 KMT2A (0.39) SMN1; SMN2LMNAALDH1A1
Hydrochloric Acid SCHEMBL5853989 0.72 NPSR1 (0.33) SMN1; SMN2NPC1RAB9ALMNAHDAC8
Hydrochloric Acid SCHEMBL5853511 0.72 KCNK3 (0.34) LMNAALDH1A1GAA

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