Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4658169

CCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Zr+2]1(C2C(CC)=Cc3c(-c4cccc5ccccc45)cccc32)CC1.[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
SLC6A2 known ✓ P23975 4/20 0.32
SLC6A3 known ✓ Q01959 4/20 0.32
SLC6A4 P31645 8/20 0.35
DRD2 P14416 1/20 0.35
HTR7 P34969 3/20 0.35
HTR1A P08908 2/20 0.33
CYP2D6 P10635 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PPARG P37231 2/20 0.31
PPARA Q07869 2/20 0.31
NISCH Q9Y2I1 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM1A O60341 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 SCHEMBL6891397 0.95 SLC6A4 (0.34) SLC6A4DRD2HTR7HTR1ASLC6A2
Hydrochloric Acid SCHEMBL4658199 0.90 SLC6A4 (0.36) SLC6A4DRD2HTR7HTR1ASLC6A2
Hydrochloric Acid SCHEMBL5951387 0.88 SLC6A4 (0.35) SLC6A4DRD2HTR7HTR1A
Hydrochloric Acid SCHEMBL6890919 0.87 KDM4E (0.41) SLC6A4DRD2HTR7HTR1ASLC6A2
Hydrochloric Acid SCHEMBL5951453 0.87 NPC1 (0.33) SLC6A4DRD2HTR7HTR1ASLC6A2
Hydrochloric Acid SCHEMBL6894669 0.87 HTR1A (0.37) SLC6A4DRD2HTR7HTR1A
Hydrochloric Acid SCHEMBL6892071 0.86 SLC6A4 (0.35) SLC6A4DRD2HTR7HTR1ASLC6A2
Hydrochloric Acid SCHEMBL6889900 0.84 SLC6A4 (0.33) SLC6A4DRD2HTR7HTR1ASLC6A2
Hydrochloric Acid SCHEMBL6892319 0.84 SLC6A4 (0.34) SLC6A4DRD2HTR7HTR1APPARG
Hydrochloric Acid SCHEMBL1032989 0.83 HTR7 (0.33) HTR7HTR1A

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783022-B2 ETHYLENIC POLYMER COMPOSITION MITSUI CHEMICALS INC (JP) 2016-01-20 EP disclosed
EP-1088836-B1 ETHYLENE/ALPHA-OLEFIN/UNCONJUGATED POLYENE COPOLYMER RUBBER, RUBBER COMPOSITION FOR SEALING, MOLDED RUBBER FOR SEALING, AND PROCESS FOR PRODUCING THE MOLDED RUBBER PART MITSUI CHEMICALS INC (JP) 2012-11-21 EP disclosed
EP-1640415-B1 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS INC (JP) 2008-12-17 EP disclosed
US-7038070-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2006-05-02 US disclosed
EP-1065241-B1 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS INC (JP) 2006-04-05 EP disclosed
EP-1640415-A2 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS, INC. (JP) 2006-03-29 EP disclosed
US-6963017-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2005-11-08 US disclosed
EP-0968158-B1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM BASELL POLYOLEFINE GMBH (DE) 2005-08-10 EP disclosed
US-20050033076-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2005-02-10 US disclosed
EP-0783022-B1 ETHYLENIC POLYMER COMPOSITION MITSUI CHEMICALS INC (JP) 2004-09-22 EP disclosed
US-6635727-B1 Random copolymer comprising structural units derived from comonomers of ethylene, one or more alpha-olefins, one or more trienes, and one or more non-conjugated polyenes in specified amounts and having specified intrinsic viscosity MITSUI CHEMICALS, INC. (JP) 2003-10-21 US disclosed
US-6635705-B2 Crosslinked crystalline polyolefin resin, an ethylene-alpha-olefin-non-conjugated polyene copolymer rubber, and polyisobutylene, butyl rubber or a propylene-ethylene copolymer MITSUI CHEMICALS, INC. (JP) 2003-10-21 US disclosed
US-20030009046-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2003-01-09 US disclosed
US-6410650-B1 MOLDING MATERIALS MITSUI CHEMICALS INC (JP) 2002-06-25 US disclosed
US-20020055591-A1 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS, INC. 2002-05-09 US disclosed
EP-1152016-A1 ETHYLENE COPOLYMER RUBBER, PROCESS FOR PRODUCING THE SAME, AND USE Mitsui Chemicals, Inc. (JP) 2001-11-07 EP disclosed
EP-1088836-A1 ETHYLENE/ALPHA-OLEFIN/UNCONJUGATED POLYENE COPOLYMER RUBBER, RUBBER COMPOSITION FOR SEALING, MOLDED RUBBER FOR SEALING, AND PROCESS FOR PRODUCING THE MOLDED RUBBER Mitsui Chemicals, Inc. (JP) 2001-04-04 EP disclosed
EP-1065241-A2 Olefinic thermoplastic elastomer composition and method for producing the same Mitsui Chemicals, Inc. (JP) 2001-01-03 EP disclosed
US-6063871-A SPECIFIC HIGH-DENSITY ETHYLENE POLYMER AND A SPECIFIC ETHYLENE POLYMER, IN WHICH AT LEAST ONE IS PREPARED USING A METALLOCENE CATALYST, AND THE DENSITY RATIO THEREBETWEEN EXCEEDS 1; MOLDABILITY, CRACK RESISTANCE, STRENGTH AND RIGIDITY MITSUI PETROCHEMICAL INDUSTRIES, INC. (JP) 2000-05-16 US disclosed
EP-0783022-A1 ETHYLENIC POLYMER COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-07-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050033076-A1 Preparation of preparing substituted indanones CYP1A2, CYP2J2, IDH3A SLC6A2 4252/4885SLC6A3 4099/4885SLC6A4 4673/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 SLC6A2 4372/4885SLC6A3 4193/4885SLC6A4 4703/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.