Bicarbonate

Bicarbonate

SCHEMBL28469716

CCOC(=O)Oc1ccc(C)cc1OC.CCOC(=O)Oc1ccc(C)cc1OC.O=C(O)O

nearest known ligand 0.52

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
ACHE P22303 1/20 0.52
L3MBTL1 Q9Y468 4/20 0.48
ALDH1A1 P00352 3/20 0.48
TSHR P16473 2/20 0.45
KDM4E B2RXH2 3/20 0.44
CTNNB1 P35222 1/20 0.44
WNT3A P56704 1/20 0.44
MAPT P10636 3/20 0.44
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
ABL1 P00519 1/20 0.44
RIN1 Q13671 1/20 0.44
NPSR1 Q6W5P4 2/20 0.43
HSP90AA1 P07900 1/20 0.43
HPGD P15428 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 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
SCHEMBL18130855 0.97 ACHE (0.55) ACHEL3MBTL1ALDH1A1TSHRKDM4E
SCHEMBL29852164 0.97 ACHE (0.55) ACHEL3MBTL1ALDH1A1TSHRKDM4E
SCHEMBL14363150 0.89 CYP1A2 (0.46) ACHEALDH1A1TSHRKDM4EMAPT
SCHEMBL28879153 0.85 ACHE (0.65) ACHEL3MBTL1ALDH1A1TSHRCTNNB1
SCHEMBL28469718 0.84 ACHE (0.52) ACHEL3MBTL1ALDH1A1TSHRKDM4E
SCHEMBL6565869 0.83 TSHR (0.68) ALDH1A1TSHRKDM4EMAPTHTT
SCHEMBL2565359 0.82 ACHE (0.61) ACHEL3MBTL1ALDH1A1TSHRKDM4E
SCHEMBL30474574 0.82 ACHE (0.61) ACHEL3MBTL1ALDH1A1TSHRKDM4E
SCHEMBL10961835 0.81 L3MBTL1 (0.48) ACHEL3MBTL1ALDH1A1KDM4ECTNNB1
SCHEMBL1598817 0.80 SMN1; SMN2 (0.51) L3MBTL1ALDH1A1KDM4EMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114867833-A Laundry compositions 弗门尼舍有限公司 2022-08-05 CN disclosed
CN-114829568-A Perfume delivery system 弗门尼舍有限公司 2022-07-29 CN disclosed
CN-114829567-A Perfume formulations for delivery systems 弗门尼舍有限公司 2022-07-29 CN disclosed
CN-107666897-B Microcapsules with high surface deposition 弗门尼舍有限公司 2021-12-28 CN disclosed
CN-113747880-A Hybrid microcapsules 弗门尼舍有限公司 2021-12-03 CN disclosed
CN-113573804-A Cleavable polyol-based microcapsules 弗门尼舍有限公司 2021-10-29 CN disclosed
CN-113557081-A Poly (amide-ester) microcapsules 弗门尼舍有限公司 2021-10-26 CN disclosed
CN-113557082-A Composite microcapsule 弗门尼舍有限公司 2021-10-26 CN disclosed
CN-113329811-A Poly (ester urea) microcapsules 弗门尼舍有限公司 2021-08-31 CN disclosed
CN-113329812-A Method for preparing microcapsules 弗门尼舍有限公司 2021-08-31 CN disclosed
CN-113226532-A Polyamide microcapsules 弗门尼舍有限公司 2021-08-06 CN disclosed
CN-113195091-A Method for producing polyamide microcapsules 弗门尼舍有限公司 2021-07-30 CN disclosed
CN-107427807-B Process for preparing polyurea microcapsules 弗门尼舍有限公司 2021-06-18 CN disclosed
CN-111918714-A Method for preparing microcapsules 弗门尼舍有限公司 2020-11-10 CN disclosed
CN-111886071-A Method for preparing mineralized microcapsules 弗门尼舍有限公司 2020-11-03 CN disclosed
CN-111801155-A Method for preparing microcapsules 弗门尼舍有限公司 2020-10-20 CN disclosed