Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7927398

O=C(O[Ti+](OC(=O)c1cccc2ccccc12)C1CCCC2=C1CC1=C2CCCC1)c1cccc2ccccc12.[Cl-]

nearest known ligand 0.37

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
GAA P10253 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 3/20 0.34
HRH3 Q9Y5N1 1/20 0.33
NPC1 O15118 2/20 0.33
NR4A1 P22736 1/20 0.33
NR4A2 P43354 1/20 0.33
NR4A3 Q92570 1/20 0.33
TLR2 O60603 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
SSTR3 P32745 1/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
LGALS9 O00182 1/20 0.31
LGALS8 O00214 1/20 0.31
LGALS1 P09382 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
SCHEMBL7925524 0.96 KMT2A (0.36) GAAKMT2APOLBKDM4EALDH1A1
Hydrochloric Acid SCHEMBL7927214 0.82 KMT2A (0.34) KMT2AKDM4EALDH1A1MEN1
Hydrochloric Acid SCHEMBL7928323 0.82 GAA (0.36) GAAKMT2APOLBKDM4EALDH1A1
Hydrochloric Acid SCHEMBL7925472 0.80 GAA (0.38) GAAKMT2APOLBKDM4EALDH1A1
Hydrochloric Acid SCHEMBL7927393 0.80 POLB (0.43) GAAKMT2APOLBKDM4EALDH1A1
SCHEMBL7925366 0.79 KMT2A (0.35) GAAKMT2APOLBKDM4EALDH1A1
SCHEMBL7927655 0.78 KMT2A (0.33) KMT2AKDM4EALDH1A1MEN1
SCHEMBL7925415 0.78 GAA (0.38) GAAKMT2APOLBKDM4EALDH1A1
SCHEMBL7925421 0.76 KMT2A (0.36) GAAKMT2APOLBKDM4EALDH1A1
SCHEMBL7924826 0.76 GAA (0.36) GAAKMT2APOLBKDM4EALDH1A1

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
EP-0867454-B1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN CO (JP) 2001-03-21 EP disclosed
US-6075102-A Polymerization catalyst and process for producing polymers IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed