Bicarbonate

Bicarbonate

SCHEMBL2863058

Cc1ccnc(Nc2cccc(-c3cnc(CN4CCNC(=O)C4)s3)n2)c1.O=C(O)O.[KH]

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Bicarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.49
KARS1 Q15046 10/20 0.45
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39

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
SCHEMBL2859014 0.96 KARS1 (0.48) SYKKARS1PDCD1CD274
Bicarbonate SCHEMBL2863054 0.95 SYK (0.48) SYKKARS1PDCD1CD274
Bicarbonate SCHEMBL2863059 0.94 SYK (0.47) SYKKARS1PDCD1CD274
SCHEMBL2862008 0.87 SYK (0.50) SYKKARS1
SCHEMBL2865835 0.86 KARS1 (0.56) SYKKARS1
SCHEMBL13136201 0.83 SYK (0.56) SYKKARS1
SCHEMBL13136222 0.82 KDR (0.53) SYKKARS1
Potassium Ion SCHEMBL2863056 0.82 SYK (0.45) SYKKARS1
SCHEMBL2873197 0.82 SYK (0.45) SYKKARS1
SCHEMBL13136477 0.81 SYK (0.47) SYKKARS1

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
US-7803801-B2 Aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO, INC. (JP) 2010-09-28 US disclosed
EP-1854793-A1 NOVEL AMINOPYRIDINE COMPOUND WITH Syk INHIBITORY ACTIVITY Japan Tobacco, Inc. (JP) 2007-11-14 EP disclosed
US-20060205731-A1 Novel aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO INC. (JP) 2006-09-14 US 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 (1 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-20060205731-A1 Novel aminopyridine compounds having Syk inhibitory activity SYK, BTK, ZAP70 SYK 1/4885KARS1 2175/4885PDCD1 1601/4885

“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.