Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3293370

O=C(O)CCC1=Cc2cc3ccc(cc4nc(cc5cc(CCC(=O)O)c(cc1n2)[nH]5)C=C4)[nH]3.[Cl-].[Cl-].[Cl-].[Co+3]

nearest known ligand 0.30

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 5)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 known ✓ P11229 1/20 0.30
▸ TBXAS1 P24557 1/20 0.30
▸ GPR17 Q13304 1/20 0.30
▸ APEX1 P27695 1/20 0.30
▸ KDM4E B2RXH2 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
SCHEMBL499060 0.98 GPR17 (0.31) GPR17APEX1KDM4ECHRM1
SCHEMBL498445 0.97 GPR17 (0.31) GPR17APEX1KDM4ECHRM1
Hydrochloric Acid SCHEMBL3293373 0.97 KDM4E (0.33) GPR17APEX1KDM4ECHRM1
Hydrochloric Acid SCHEMBL3293368 0.96 KDM4E (0.32) GPR17APEX1KDM4ECHRM1
Hydrochloric Acid SCHEMBL3289280 0.96 KDM4E (0.32) GPR17APEX1KDM4ECHRM1
SCHEMBL10722190 0.88 — —
SCHEMBL6410839 0.87 GPR17 (0.33) TBXAS1GPR17APEX1KDM4ECHRM1
SCHEMBL6416150 0.87 CHRM1 (0.38) GPR17APEX1KDM4ECHRM1
Hydrochloric Acid SCHEMBL3289386 0.84 KDM4E (0.36) GPR17APEX1KDM4ECHRM1
SCHEMBL11894595 0.81 RAD52 (0.30) —

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1798600-B1 Use of a porhine agent for reducing the potential of ghosting in an imaging member XEROX CORP (US) 2012-10-10 — — EP claimed
US-7718334-B2 Imaging member having porphine or porphine derivatives XEROX CORPORATION (US) 2010-05-18 — — US claimed
US-20070141490-A1 Imaging member U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL AGENT 2007-06-21 — — US claimed
EP-1798600-A1 Imaging Member Xerox Corporation (US) 2007-06-20 — — EP claimed
EP-1798600-B1 Use of a porhine agent for reducing the potential of ghosting in an imaging member XEROX CORP (US) 2012-10-10 — — EP disclosed
US-7527904-B2 Imaging member XEROX CORPORATION (US) 2009-05-05 — — US disclosed
US-20070141490-A1 Imaging member U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL AGENT 2007-06-21 — — US disclosed
EP-1798600-A1 Imaging Member Xerox Corporation (US) 2007-06-20 — — EP disclosed
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