Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.31 |
| ▸ | FABP3 | P05413 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Butyric Acid SCHEMBL526832 | 0.90 | FFAR3 (0.41) | CA1CA2GPR84FFAR3HDAC3 | |
| Propionic Acid SCHEMBL528118 | 0.87 | GPR84 (0.36) | CA1CA2GPR84 | |
| Levulinic Acid SCHEMBL535036 | 0.86 | CA1 (0.35) | CA1CA2GPR84FFAR3HDAC3 | |
| Beta-Alanine SCHEMBL16345992 | 0.86 | FFAR3 (0.31) | FFAR3HDAC3HDAC1HDAC2HDAC8 | |
| Acetic Acid SCHEMBL232563 | 0.86 | GPR84 (0.33) | GPR84 | |
| Bicarbonate SCHEMBL1490995 | 0.86 | ALDH1A1 (0.34) | GPR84 | |
| Alanine SCHEMBL16346797 | 0.82 | CA1 (0.33) | CA1 | |
| SCHEMBL535111 | 0.82 | CA1 (0.34) | CA1CA2GPR84 | |
| Pivalate SCHEMBL15287009 | 0.82 | NPC1 (0.32) | GPR84 | |
| L-Lactic Acid SCHEMBL3643630 | 0.81 | CA1 (0.33) | CA1GPR84 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015000637-A1 | ABSORPTION MEDIUM AND METHOD FOR ABSORPTION OF CO2 FROM A GAS MIXTURE, WHEREIN THE MEDIUM COMPRISES WATER, AN AMINE AND AN ORGANIC SALT | EVONIK DEGUSSA GMBH (DE) | 2015-01-08 | — | — | WO | disclosed |