Bicarbonate

Bicarbonate

SCHEMBL14715657

Cc1ccc(C(=O)NC2CC2)cc1-c1ccc2nc(NC3CCCC3)ncc2c1.O=C(O)O

nearest known ligand 0.63

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 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.63
LCK P06239 6/20 0.63
KDR P35968 6/20 0.63
KIT P10721 4/20 0.63
MAPK9 P45984 2/20 0.63
MAPK10 P53779 2/20 0.63
JAK3 P52333 2/20 0.62
ABL1 P00519 3/20 0.60
CSF1R P07333 1/20 0.57

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
SCHEMBL5491560 0.97 MAPK14 (0.64) MAPK14LCKKDRKITMAPK9
Bicarbonate SCHEMBL14715594 0.97 MAPK14 (0.66) MAPK14LCKKDRKITMAPK9
SCHEMBL14569075 0.91 MAPK14 (0.63) MAPK14LCKKDRKITMAPK9
SCHEMBL5495649 0.90 MAPK14 (0.62) MAPK14LCKKDRKITMAPK9
SCHEMBL14715687 0.89 MAPK14 (0.64) MAPK14LCKKDRKITMAPK9
SCHEMBL14569073 0.89 MAPK14 (0.63) MAPK14LCKKDRKITMAPK9
SCHEMBL5488775 0.89 MAPK14 (0.69) MAPK14LCKKDRKITMAPK9
SCHEMBL14724721 0.89 MAPK14 (0.62) MAPK14LCKKDRKITMAPK9
SCHEMBL21416867 0.89 MAPK14 (0.59) MAPK14LCKKDRKITMAPK9
SCHEMBL5494682 0.89 MAPK14 (0.59) MAPK14LCKKDRKITMAPK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836174-B2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2019-10-02 EP claimed
EP-1836174-B1 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2013-02-27 EP claimed