Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7925867

CC1C2=C(CCCC2)C2=C1C([Ti+2]OC(=O)c1ccc(F)cc1)CCC2.[Cl-].[Cl-]

nearest known ligand 0.35

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 17)

geneUniProtsupporting neighboursconfidence
SLC6A3 known ✓ Q01959 2/20 0.31
KMT2A Q03164 7/20 0.35
MEN1 O00255 6/20 0.35
KDM4E B2RXH2 1/20 0.33
MAPT P10636 2/20 0.32
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
ALDH1A1 P00352 1/20 0.31
NPC1 O15118 3/20 0.31
RAB9A P51151 3/20 0.31
HTT P42858 2/20 0.31
MAPK1 P28482 2/20 0.31
SLC6A4 P31645 1/20 0.31
ATM Q13315 1/20 0.30
PPARG P37231 1/20 0.30

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
SCHEMBL7928302 0.97 MEN1 (0.35) KMT2AMEN1KDM4EMAPTCASP3
Hydrochloric Acid SCHEMBL7924563 0.88 LMNA (0.34) KMT2AMEN1MAPTALDH1A1HTT
Hydrochloric Acid SCHEMBL7930894 0.82
Hydrochloric Acid SCHEMBL7927366 0.80 KDM4E (0.38) KMT2AMEN1KDM4EMAPTCASP3
Hydrochloric Acid SCHEMBL7924965 0.80 MEN1 (0.34) KMT2AMEN1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL7927362 0.79 MEN1 (0.36) KMT2AMEN1KDM4EMAPTCASP3
Hydrochloric Acid SCHEMBL7924955 0.79
SCHEMBL7925721 0.79 MEN1 (0.35) KMT2AMEN1KDM4EMAPTALDH1A1
SCHEMBL7924740 0.78 KDM4E (0.37) KMT2AMEN1KDM4EMAPTCASP3
SCHEMBL7919162 0.78

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