Bicarbonate

Bicarbonate

SCHEMBL7570288

CC(C)(CCCN1CCC(NC(=O)c2cc(Cl)ccc2-c2ccccc2)CC1)c1ccccc1.O=C(O)O

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 13)

geneUniProtsupporting neighboursconfidence
▸ SLC6A12 P48065 1/20 0.49
▸ HTR7 P34969 3/20 0.49
▸ HTR1A P08908 2/20 0.49
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CCR3 P51677 2/20 0.43
▸ ADRA1D P25100 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ ADRA1B P35368 1/20 0.43
▸ DRD4 P21917 2/20 0.43
▸ CCR1 P32246 1/20 0.43
▸ HTR4 Q13639 2/20 0.42
▸ POLB P06746 1/20 0.42

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 SCHEMBL7569224 0.91 HTR7 (0.43) HTR7MEN1KMT2ACCR3ADRA1D
Bicarbonate SCHEMBL6219322 0.91 MTTP (0.49) SLC6A12HTR7HTR1AMEN1KMT2A
Bicarbonate SCHEMBL7570482 0.90 SLC6A12 (0.47) SLC6A12HTR7HTR1AMEN1KMT2A
Bicarbonate SCHEMBL7565748 0.89 POLB (0.50) HTR7CCR3DRD4HTR4POLB
SCHEMBL7570284 0.89 SLC6A12 (0.47) SLC6A12HTR7HTR1AMEN1KMT2A
SCHEMBL7570480 0.85 SLC6A12 (0.48) SLC6A12HTR7HTR1ACCR3HTR4
Bicarbonate SCHEMBL7568842 0.85 CCR3 (0.48) SLC6A12HTR7CCR3ADRA1DADRA1A
Bicarbonate SCHEMBL6220685 0.84 MTTP (0.49) HTR7MEN1KMT2ACCR3ADRA1D
SCHEMBL7234407 0.84 SLC6A12 (0.44) SLC6A12HTR7HTR1ACCR3ADRA1A
SCHEMBL7235323 0.83 KCNA3 (0.45) SLC6A12HTR7HTR1ACCR3ADRA1A

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-1202969-A2 BIPHENYL DERIVATIVES, PRODUCTION THEREOF AND USE AS MEDICINES Boehringer Ingelheim Pharma KG (DE) 2002-05-08 — — EP disclosed
WO-2001005762-A2 BIPHENYL DERIVATIVES, PRODUCTION THEREOF AND USE AS MTP INHIBITORS BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-01-25 — — WO disclosed
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