Known targets — ChEMBL curated mechanism
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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL509113 | 1.00 | — | — | |
| Bicarbonate SCHEMBL28732046 | 1.00 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL23213376 | 1.00 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL7626323 | 1.00 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL4076526 | 0.93 | — | — | |
| Bicarbonate SCHEMBL3288124 | 0.93 | — | — | |
| Bicarbonate SCHEMBL4076529 | 0.93 | — | — | |
| Bicarbonate SCHEMBL11493121 | 0.93 | — | — | |
| Bicarbonate SCHEMBL16637902 | 0.93 | — | — | |
| Bicarbonate SCHEMBL25426249 | 0.93 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102605033-B | Method for preparing cefazolin intermediate TDA | HUNAN FLAG BIOLOG TECHNOLOGY CO LTD | 2013-11-27 | — | — | CN | disclosed |
| CN-102605033-A | Method for preparing cefazolin intermediate TDA (7-amino-3-[(5-methyl-1,3,4-thiadiazol-2yl)thiomethyl]-3-cephalosporanicacid) | HUNAN FLAG BIOLOG TECHNOLOGY CO LTD | 2012-07-25 | — | — | CN | disclosed |
| CN-1531598-A | Enzymatic process for preparing cephalosporanic acid derivatives | ��ŷ�����¶����ǹɷ�����˾ | 2004-09-22 | — | — | CN | disclosed |
| US-20040067549-A1 | Process for preparing cephalosporin derivatives | BIOFERMA MURCIA S.A. | 2004-04-08 | — | — | US | disclosed |
| EP-1381690-A2 | ENZYMATIC PROCESS FOR PREPARING CEPHALOSPORIN DERIVATIVES | Bioferma Murcia, S.A. (ES) | 2004-01-21 | — | — | EP | disclosed |
| US-6642020-B2 | Enzymatically converting a 3-thiolated cephalosporin C compound to form a 3-thiolated -glutaryl-7-amino cephalosporanic acid compound; enzymatically converting to form 3-thiolated-7-amino cephalosporanic acid compound | BIOFERMA MURCIA S.A. (ES) | 2003-11-04 | — | — | US | disclosed |
| US-20030073156-A1 | Process for preparing cephalosporin derivatives | BIOFERMA MURCIA S.A. (ES) | 2003-04-17 | — | — | US | disclosed |
| WO-2002086143-A2 | ENZYMATIC PROCESS FOR PREPARING CEPHALOSPORIN DERIVATIVES | BIOFERMA MURCIA, S.A. (ES) | 2002-10-31 | — | — | WO | disclosed |