Bicarbonate

Bicarbonate

SCHEMBL7341573

CN(C)c1cccc(C(=O)Oc2ccc3cc(C(=N)N)ccc3c2)c1.CN(C)c1cccc(C(=O)Oc2ccc3cc(C(=N)N)ccc3c2)c1.O=C(O)O

nearest known ligand 0.54

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 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 2/20 0.54
▸ F12 P00748 9/20 0.54
▸ F2 P00734 6/20 0.54
▸ F10 P00742 5/20 0.54
▸ PRSS1 P07477 4/20 0.54
▸ PLG P00747 4/20 0.54
▸ MAPT P10636 2/20 0.54
▸ C1R P00736 2/20 0.54
▸ KLK1 P06870 2/20 0.54
▸ HGFAC Q04756 2/20 0.54
▸ TMPRSS2 O15393 1/20 0.54
▸ MLNR O43193 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ ITGB3 P05106 1/20 0.54
▸ HPN P05981 1/20 0.54
▸ CHRM2 P08172 1/20 0.54
▸ ITGA2B P08514 1/20 0.54
▸ C1S P09871 1/20 0.54
▸ ADORA3 P0DMS8 1/20 0.54

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
Bicarbonate SCHEMBL10918389 1.00 PLAU (0.54) PLAUF12F2F10PRSS1
SCHEMBL7341983 0.98 F12 (0.56) PLAUF12F2F10PRSS1
Acetic Acid SCHEMBL7340710 0.97 PLAU (0.53) PLAUF12F2F10PRSS1
SCHEMBL10918392 0.89 PLAU (0.49) PLAUF12F2F10PRSS1
SCHEMBL7348791 0.85 F12 (0.64) PLAUF12F2F10PRSS1
SCHEMBL7337750 0.82 F12 (0.71) PLAUF12F2F10PRSS1
SCHEMBL7342919 0.82 KMT2A (0.64) PLAUF12F2F10PRSS1
SCHEMBL7347942 0.80 FTO (0.70) PLAUF12F2F10PRSS1
SCHEMBL10922456 0.78 FTO (0.74) PLAUF12F2F10PRSS1
SCHEMBL31380450 0.78 F12 (0.76) PLAUF12F2F10PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4454338-A 6-AMIDINO-2-NATHTHYL-4-GUANIDINOBENZOATE TORII & CO., LTD. (JP) 1984-06-12 — — US disclosed
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