Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.53 |
| ▸ | CA9 | Q16790 | 6/20 | 0.53 |
| ▸ | CA12 | O43570 | 5/20 | 0.53 |
| ▸ | CA1 | P00915 | 5/20 | 0.53 |
| ▸ | F10 | P00742 | 2/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.49 |
| ▸ | CA6 | P23280 | 3/20 | 0.47 |
| ▸ | CA5A | P35218 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.47 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.46 |
| ▸ | FEN1 | P39748 | 3/20 | 0.46 |
| ▸ | CA4 | P22748 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.45 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8659816 | 0.93 | CA2 (0.50) | CA2CA9CA12CA1F10 | |
| SCHEMBL8350056 | 0.90 | CA1 (0.54) | CA2CA9CA12CA1PTGS1 | |
| SCHEMBL8662912 | 0.84 | PTGS2 (0.66) | PTGS1PTGS2ALOX5APFEN1 | |
| SCHEMBL9693255 | 0.84 | NAMPT (0.45) | CA2CA9CA12CA1PTGS2 | |
| SCHEMBL48885 | 0.84 | CA2 (0.52) | CA2CA9CA12CA1F10 | |
| SCHEMBL7265178 | 0.82 | PTGS2 (0.50) | CA2CA9CA12CA1PTGS2 | |
| SCHEMBL30940556 | 0.82 | CA1 (0.52) | CA2CA9CA12CA1F10 | |
| SCHEMBL890792 | 0.82 | CA1 (0.52) | CA2CA9CA12CA1F10 | |
| SCHEMBL27954274 | 0.82 | CA2 (0.65) | CA2CA9CA12CA1PTGS1 | |
| Hydrochloric Acid SCHEMBL6399557 | 0.82 | CA2 (0.50) | CA2CA9CA12CA1F10 |
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 |
|---|---|---|---|---|---|---|---|
| US-7199149-B2 | Monocyclic and bicyclic lactams as factor Xa inhibitors | BRISTOL MYERS SQUIBB COMPANY (US) | 2007-04-03 | — | — | US | disclosed |
| US-7199149-B2 | Monocyclic and bicyclic lactams as factor Xa inhibitors | BRISTOL MYERS SQUIBB COMPANY (US) | 2007-04-03 | — | — | US | disclosed |
| EP-0503162-B1 | Azole derivatives, process for their preparation and their application | HOECHST AG (DE) | 1998-04-22 | — | — | EP | disclosed |
| US-5482957-A | Azole derivatives, process for their preparation and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-01-09 | — | — | US | disclosed |
| EP-0526001-A1 | Substituted triazolinones | MERCK & CO. INC. (US) | 1993-02-03 | — | — | EP | disclosed |
| WO-1993001177-A1 | SUBSTITUTED TRIAZOLINONES | MERCK & CO., INC. (US) | 1993-01-21 | — | — | WO | disclosed |
| EP-0503162-A1 | Azole derivatives, process for their preparation and their application | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-09-16 | — | — | EP | disclosed |