Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9938849

CN(C)c1ccccc1Nc1ccccc1N(C)C.[Cl-].[Cl-].[Ni+2]

nearest known ligand 0.55

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
NAMPT known ✓ P43490 1/20 0.34
KDM1A O60341 1/20 0.55
EGFR P00533 3/20 0.42
MAPT P10636 3/20 0.40
GAA P10253 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.39
CHEK1 O14757 1/20 0.39
NEK2 P51955 1/20 0.39
LIMK1 P53667 1/20 0.39
DYRK1A Q13627 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
KCNQ2 O43526 1/20 0.37
FABP4 P15090 1/20 0.36
HTR6 P50406 1/20 0.35
NSD2 O96028 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL30935911 0.95 KDM1A (0.58) KDM1AEGFRMAPTGAAALDH1A1
SCHEMBL3196135 0.95 KDM1A (0.58) KDM1AEGFRMAPTGAAALDH1A1
SCHEMBL14127728 0.82 KDM1A (0.56) KDM1AEGFRMAPTGAAALDH1A1
SCHEMBL29624619 0.82 KDM1A (0.56) KDM1AEGFRMAPTGAAALDH1A1
SCHEMBL5885190 0.82 KDM1A (0.61) KDM1AEGFRMAPTGAAALDH1A1
SCHEMBL24914503 0.80 KDM1A (0.58) KDM1AMAPTGAAALDH1A1TP53
SCHEMBL25734260 0.80 KDM1A (0.46) KDM1AEGFRMAPTGAAALDH1A1
SCHEMBL6568199 0.78 KDM1A (0.47) KDM1AEGFRMAPTGAAALDH1A1
SCHEMBL31718394 0.78 KDM1A (0.47) KDM1AEGFRMAPTGAAALDH1A1
SCHEMBL24914440 0.77 KDM1A (0.56) KDM1AEGFRMAPTGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10793504-B2 Methods for cross coupling RECURIUM IP HOLDINGS, LLC (US) 2020-10-06 US claimed
US-20190202769-A1 METHODS FOR CROSS COUPLING RECURIUM IP HOLDINGS, LLC 2019-07-04 US claimed
EP-3504217-A1 METHODS FOR CROSS COUPLING Zeno Royalties & Milestones, LLC (US) 2019-07-03 EP claimed
WO-2018039232-A1 METHODS FOR CROSS COUPLING KALYRA PHARMACEUTICALS, INC. (US) 2018-03-01 WO claimed
US-10793504-B2 Methods for cross coupling RECURIUM IP HOLDINGS, LLC (US) 2020-10-06 US disclosed
US-20190202769-A1 METHODS FOR CROSS COUPLING RECURIUM IP HOLDINGS, LLC 2019-07-04 US disclosed
EP-3504217-A1 METHODS FOR CROSS COUPLING Zeno Royalties & Milestones, LLC (US) 2019-07-03 EP disclosed
WO-2018039232-A1 METHODS FOR CROSS COUPLING KALYRA PHARMACEUTICALS, INC. (US) 2018-03-01 WO disclosed
WO-2013041106-A1 SYSTEM PROVIDING CONTROLLED DELIVERY OF GASEOUS 11CO FOR CARBONYLATION REACTIONS IN THE PREPARATION OF RADIOPHARMACEUTICALS FOR PET IMAGING AARHUS UNIVERSITET (DK) 2013-03-28 WO disclosed
WO-2012079583-A1 SYSTEM PROVIDING CONTROLLED DELIVERY OF GASEOUS CO FOR CARBONYLATION REACTIONS AARHUS UNIVERSITET (DK) 2012-06-21 WO 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-20190202769-A1 METHODS FOR CROSS COUPLING F2, C5, C9 NAMPT 2907/4885KDM1A 1208/4885EGFR 3170/4885
US-10793504-B2 Methods for cross coupling F2, C5, C9 NAMPT 2907/4885KDM1A 1208/4885EGFR 3170/4885

“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.