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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 18/20 | 0.57 |
| ▸ | F2 | P00734 | 3/20 | 0.55 |
| ▸ | PRSS1 | P07477 | 7/20 | 0.54 |
| ▸ | PLG | P00747 | 1/20 | 0.51 |
| ▸ | PROC | P04070 | 1/20 | 0.51 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.51 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.51 |
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 SCHEMBL7405522 | 0.93 | F10 (0.66) | F10F2PRSS1PLGPROC | |
| SCHEMBL7406464 | 0.90 | F10 (0.57) | F10F2PRSS1PLGPROC | |
| SCHEMBL7407398 | 0.90 | F10 (0.62) | F10F2PRSS1PLGPROC | |
| SCHEMBL7406449 | 0.89 | F10 (0.56) | F10F2PRSS1PLGPROC | |
| SCHEMBL7404659 | 0.88 | F10 (0.57) | F10F2PRSS1PLGPROC | |
| SCHEMBL7401264 | 0.86 | PRSS1 (0.53) | F10F2PRSS1PLGPROC | |
| SCHEMBL7403464 | 0.85 | F10 (0.57) | F10F2PRSS1PLGPROC | |
| SCHEMBL7409027 | 0.85 | F10 (0.60) | F10F2PRSS1PLGPROC | |
| SCHEMBL7406662 | 0.84 | F10 (0.59) | F10F2PRSS1PLGPROC | |
| SCHEMBL7452197 | 0.84 | F10 (0.66) | F10F2PRSS1PLGPROC |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002030880-A2 | N-SUBSTITUTED AMINO ACID DERIVATIVES (FACTOR XA INHIBITORS) | MERCK PATENT GMBH (DE) | 2002-04-18 | — | — | WO | claimed |
| WO-2002030880-A2 | N-SUBSTITUTED AMINO ACID DERIVATIVES (FACTOR XA INHIBITORS) | MERCK PATENT GMBH (DE) | 2002-04-18 | — | — | WO | disclosed |