Bicarbonate

Bicarbonate

SCHEMBL4853074

O=C(O)O.Oc1ccc(C2(c3ccc(O)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.55

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
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
LMNA P02545 3/20 0.55
MAPT P10636 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
KDM4E B2RXH2 1/20 0.55
OPRK1 P41145 1/20 0.55
POLB P06746 1/20 0.53
GPR55 Q9Y2T6 3/20 0.50
ESR1 P03372 2/20 0.50
ESR2 Q92731 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
CHRM2 P08172 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
KCNH2 Q12809 1/20 0.50
ALDH1A1 P00352 1/20 0.50
TP53 P04637 1/20 0.50
TYMS P04818 1/20 0.50
CYP3A4 P08684 1/20 0.50
ALOX15 P16050 1/20 0.50

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
SCHEMBL516630 0.93 MEN1 (0.52) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL6756888 0.92 MEN1 (0.59) MEN1KMT2ALMNAMAPTSMN1; SMN2
Phenol SCHEMBL8103114 0.92 MEN1 (0.59) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL29365596 0.92 MEN1 (0.63) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL15691572 0.92 MEN1 (0.63) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL900116 0.92 MEN1 (0.63) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL45826 0.92 MEN1 (0.63) MEN1KMT2ALMNAMAPTSMN1; SMN2
Formaldehyde SCHEMBL972884 0.90 MEN1 (0.57) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL28240230 0.90 MEN1 (0.61) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL18184916 0.87 MMP3 (0.56) MEN1KMT2ALMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080300675-A1 POLYMERIC STENTS AND OTHER SURGICAL ARTICLES PENTCH MEDICAL DEVICED LTD., 2008-12-04 US disclosed
US-7410498-B2 Polymeric stents and other surgical articles PENTECH MEDICAL DEVICES LTD. (IL) 2008-08-12 US disclosed
EP-1416881-A4 POLYMERIC STENTS AND OTHER SURGICAL ARTICLES PENTECH MEDICAL DEVICES LTD (IL) 2004-05-12 EP disclosed
EP-1416881-A2 POLYMERIC STENTS AND OTHER SURGICAL ARTICLES Pentech Medical Devices Ltd (IL) 2004-05-12 EP disclosed
US-20030208259-A1 Polymeric stents and other surgical articles PENTECH MEDICAL DEVICES LTD. (IL) 2003-11-06 US disclosed
WO-2002000092-A2 POLYMERIC STENTS AND OTHER SURGICAL ARTICLES PENTECH MEDICAL DEVICES LTD. (IL) 2002-01-03 WO disclosed
EP-0704065-B1 OCULAR LENS COMPOSITION AND METHOD OF FORMATION RASOR ASS INC (US) 2000-05-03 EP disclosed
US-5986001-A THERMOFORMED GAS PERMEABLE LENSE WITH INTERPENETRATING NETWORK RASOR ASSOCIATES, INC. (US) 1999-11-16 US disclosed
US-5789483-A GAS PERMEABLE RASOR ASSOCIATES, INC. (US) 1998-08-04 US disclosed
US-5723541-A BLOCK POLYMER BLEND FOR LENSES OF SILICONES OR FLUOROPOLYMERS WITH POLYCARBONATES, POLYSULFONES AND POLYSTYRENE WITH ACRYLATES, METHACRYLATES, PYRROLIDONE, AMIDE AND NITRILES RASOR ASSOCIATES, INC. (US) 1998-03-03 US disclosed
EP-0704065-A1 OCULAR LENS COMPOSITION AND METHOD OF FORMATION RASOR ASSOCIATES, INC. (US) 1996-04-03 EP disclosed
WO-1994029756-A2 OCULAR LENS COMPOSITION AND METHOD OF FORMATION RASOR ASSOCIATES, INC. (US) 1994-12-22 WO disclosed