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.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | CES2 | O00748 | 3/20 | 0.53 |
| ▸ | CES1 | P23141 | 3/20 | 0.53 |
| ▸ | PTPRC | P08575 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | RECQL | P46063 | 3/20 | 0.53 |
| ▸ | THRB | P10828 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | APAF1 | O14727 | 2/20 | 0.53 |
| ▸ | TDP2 | O95551 | 2/20 | 0.53 |
| ▸ | BLM | P54132 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | TERT | O14746 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.53 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.53 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.53 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL4599245 | 1.00 | MAPT (0.53) | MAPTMEN1KMT2ACES2CES1 | |
| Bicarbonate SCHEMBL11246116 | 1.00 | MAPT (0.53) | MAPTMEN1KMT2ACES2CES1 | |
| Acetic Acid SCHEMBL11385294 | 0.86 | CES2 (0.50) | MAPTMEN1KMT2ACES2CES1 | |
| Benzene SCHEMBL27898037 | 0.83 | MEN1 (0.57) | MAPTMEN1KMT2ACES2CES1 | |
| SCHEMBL31290736 | 0.83 | MEN1 (0.57) | MAPTMEN1KMT2ACES2CES1 | |
| Bicarbonate SCHEMBL10531683 | 0.83 | BCAT2 (0.58) | MEN1KMT2ARECQLTHRBMAPK1 | |
| Bicarbonate SCHEMBL10341263 | 0.83 | BCAT2 (0.58) | MEN1KMT2ARECQLTHRBMAPK1 | |
| Urea SCHEMBL6255302 | 0.81 | KMT2A (0.50) | MAPTMEN1KMT2ACES2CES1 | |
| Acetone SCHEMBL27562549 | 0.81 | POLB (0.50) | MAPTMEN1KMT2ACES2CES1 | |
| Terephthalic Acid SCHEMBL9337978 | 0.81 | TSHR (0.72) | CES2CES1PTPRCSMN1; SMN2ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1888817-A2 | METHOD FOR PRODUCING POROUS METAL-ORGANIC FRAMEWORK MATERIALS | BASF AKTIENGESELLSCHAFT (DE) | 2008-02-20 | — | — | EP | claimed |
| WO-2006125761-A2 | METHOD FOR PRODUCING POROUS METAL-ORGANIC FRAMEWORK MATERIALS | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-30 | — | — | WO | claimed |
| EP-1060207-B1 | POLYMERIZATION CATALYSTS FOR POLYESTERS | ALLIED SIGNAL INC (US) | 2004-08-11 | — | — | EP | claimed |
| EP-1888817-A2 | METHOD FOR PRODUCING POROUS METAL-ORGANIC FRAMEWORK MATERIALS | BASF AKTIENGESELLSCHAFT (DE) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006125761-A2 | METHOD FOR PRODUCING POROUS METAL-ORGANIC FRAMEWORK MATERIALS | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-30 | — | — | WO | disclosed |