Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5856502

Cc1cccc(C(=O)N[Ti+2](C2c3ccccc3-c3ccccc32)[SiH](c2ccccc2)c2ccccc2)c1.[Cl-].[Cl-]

nearest known ligand 0.48

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 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
POLB P06746 2/20 0.44
KCNK3 O14649 2/20 0.44
KCNK9 Q9NPC2 2/20 0.44
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
MAPT P10636 3/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRK1 P41145 1/20 0.41
KCNH2 Q12809 1/20 0.41
KAT6A Q92794 1/20 0.41
NT5E P21589 1/20 0.40

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 SCHEMBL5852780 0.92 MEN1 (0.39) SMN1; SMN2KMT2AMEN1POLBKCNK3
Hydrochloric Acid SCHEMBL5853726 0.89 MEN1 (0.39) KMT2AMEN1POLBKCNK3KCNK9
Hydrochloric Acid SCHEMBL5855442 0.86 SMN1; SMN2 (0.48) SMN1; SMN2KMT2AMEN1POLBKCNK3
Hydrochloric Acid SCHEMBL5853942 0.85 NR1H4 (0.41) SMN1; SMN2KMT2AMEN1KCNK3KCNK9
Hydrochloric Acid SCHEMBL5852827 0.85 KMT2A (0.38) KMT2AMEN1MAPTALDH1A1LMNA
Hydrochloric Acid SCHEMBL5853669 0.83 TAS1R3 (0.38) KMT2AMEN1POLBLMNA
Hydrochloric Acid SCHEMBL5855370 0.82 HPGD (0.40) SMN1; SMN2KMT2APOLBKCNK3KCNK9
Hydrochloric Acid SCHEMBL5855558 0.81 POLB (0.37) KMT2AMEN1POLBHDAC8HDAC6
Hydrochloric Acid SCHEMBL5853485 0.80 SMN1; SMN2 (0.44) SMN1; SMN2KMT2AMEN1POLBKCNK3
Hydrochloric Acid SCHEMBL5855150 0.78 LMNA (0.36) KMT2AKCNK3KCNK9LMNA

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