Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | FABP3 | P05413 | 6/20 | 0.34 |
| ▸ | CES1 | P23141 | 6/20 | 0.33 |
| ▸ | CES2 | O00748 | 5/20 | 0.33 |
| ▸ | EP300 | Q09472 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL4020981 | 0.81 | CA1 (0.44) | CA1FABP3CES1CES2 | |
| SCHEMBL457298 | 0.79 | FFAR3 (0.31) | — | |
| Bicarbonate SCHEMBL27704869 | 0.79 | CA1 (0.46) | CA1CES1CES2 | |
| Pyruvate SCHEMBL2145303 | 0.77 | CA4 (0.48) | CA1FABP3CES1CES2 | |
| Acetic Acid SCHEMBL37323 | 0.77 | CES1 (0.44) | CA1CES1CES2 | |
| SCHEMBL384090 | 0.75 | CES1 (0.39) | CA1FABP3CES1CES2 | |
| Fumaric Acid SCHEMBL48771 | 0.75 | CA1 (0.39) | CA1FABP3CES1CES2 | |
| Fumaric Acid SCHEMBL621871 | 0.75 | CA1 (0.39) | CA1FABP3CES1CES2 | |
| Fumaric Acid SCHEMBL8378110 | 0.75 | CA1 (0.39) | CA1FABP3CES1CES2 | |
| Glyoxylate SCHEMBL29391305 | 0.75 | CA1 (0.39) | CA1FABP3CES1CES2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130165619-A1 | LIGHT-FAST POLYURETHANES AND USE THEREOF | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2013-06-27 | — | — | US | disclosed |
| EP-2603538-A1 | LIGHT-FAST POLYURETHANES AND USE THEREOF | Bayer Intellectual Property GmbH (DE) | 2013-06-19 | — | — | EP | disclosed |
| WO-2012020027-A1 | LIGHT-FAST POLYURETHANES AND USE THEREOF | BAYER MATERIALSCIENCE AG (DE) | 2012-02-16 | — | — | WO | disclosed |