Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1401395 | 0.95 | CA1 (0.44) | CA1CA2HSD11B1PRKCZPTGS1 | |
| SCHEMBL9250996 | 0.85 | MAPT (0.38) | CA1CA2PRKCZCYP3A4ROCK1 | |
| SCHEMBL4056753 | 0.84 | CA1 (0.51) | CA1CA2HSD11B1CA9HTR1A | |
| SCHEMBL16863083 | 0.83 | CA1 (0.47) | CA1CA2HSD11B1CA9HTR1A | |
| SCHEMBL9250998 | 0.82 | PRKCZ (0.37) | CA1CA2PRKCZCYP3A4ROCK1 | |
| SCHEMBL13933202 | 0.81 | CA1 (0.49) | CA1CA2HSD11B1CA9HTR1A | |
| SCHEMBL598333 | 0.81 | CA1 (0.50) | CA1CA2HSD11B1CA9HTR1A | |
| SCHEMBL2422700 | 0.78 | CA1 (0.38) | CA1CA2PTGS1PTGS2IKBKB | |
| SCHEMBL1713420 | 0.78 | CA1 (0.61) | CA1CA2HSD11B1CA9HTR1A | |
| SCHEMBL29839512 | 0.78 | CA1 (0.61) | CA1CA2HSD11B1CA9HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0528369-B1 | Cyclic imino derivatives, pharmaceutical compositions containing them and process for their preparation | BOEHRINGER INGELHEIM PHARMA (DE) | 1999-11-24 | — | — | EP | disclosed |
| US-5455348-A | Anticoagulants | Thomae, Karl (DE) | 1995-10-03 | — | — | US | disclosed |
| EP-0528369-A2 | Cyclic imino derivatives, pharmaceutical compositions containing them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1993-02-24 | — | — | EP | disclosed |