Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2097461 | 0.80 | CA1 (0.33) | CA1CA2ADRB2ADRB1ADRB3 | |
| SCHEMBL2422140 | 0.78 | — | — | |
| SCHEMBL6929495 | 0.78 | CA1 (0.32) | CA1CA2ADRB2ADRB1ADRB3 | |
| SCHEMBL5880353 | 0.75 | — | — | |
| SCHEMBL6928943 | 0.75 | CA1 (0.31) | CA1CA2 | |
| SCHEMBL2423646 | 0.75 | CA1 (0.31) | CA1CA2 | |
| SCHEMBL16935653 | 0.73 | FDPS (0.32) | — | |
| SCHEMBL17513009 | 0.73 | CA1 (0.35) | CA1CA2 | |
| SCHEMBL19360695 | 0.73 | — | — | |
| SCHEMBL2419129 | 0.73 | FDPS (0.32) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0672698-B1 | Process for the preparation of optionally cellular polyurethanes and/or polyurethanecureas | BAYER AG (DE) | 1999-01-13 | — | — | EP | disclosed |
| EP-0672694-B1 | Process for the preparation of optionally cellular polyurethanes | BAYER AG (DE) | 1998-01-28 | — | — | EP | disclosed |
| EP-0579080-B1 | Storage-stable, mould release agents-containing polyol compositions | BAYER AG (DE) | 1997-04-23 | — | — | EP | disclosed |
| EP-0672698-A1 | Process for the preparation of optionally cellular polyurethanes and/or polyurethanecureas | BAYER AG (DE) | 1995-09-20 | — | — | EP | disclosed |
| EP-0672694-A1 | Process for the preparation of optionally cellular polyurethanes | BAYER AG (DE) | 1995-09-20 | — | — | EP | disclosed |
| US-5344853-A | Amine salt,-NH amide or carbamate function, polyurethanes | BAYER AKTIENGESELLSCHAFT (DE) | 1994-09-06 | — | — | US | disclosed |
| EP-0579080-A2 | Storage-stable, mould release agents-containing polyol compositions | BAYER AG (DE) | 1994-01-19 | — | — | EP | disclosed |