Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ATIC | P31939 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.32 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.32 |
| ▸ | RAF1 | P04049 | 1/20 | 0.32 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.32 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.32 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 3/20 | 0.31 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13735762 | 0.72 | ALDH1A1 (0.65) | ALDH1A1POLBRXFP1KDM4ECYP3A4 | |
| SCHEMBL13735766 | 0.70 | ALDH1A1 (0.63) | ALDH1A1POLBRXFP1KDM4ECYP3A4 | |
| SCHEMBL2775270 | 0.67 | ALDH1A1 (0.44) | ALDH1A1POLBRXFP1KDM4ECYP3A4 | |
| SCHEMBL18050892 | 0.67 | ALDH1A1 (0.44) | ALDH1A1POLBRXFP1KDM4ECYP3A4 | |
| SCHEMBL5742205 | 0.65 | ALDH1A1 (0.52) | ALDH1A1POLBRXFP1KDM4ECYP3A4 | |
| SCHEMBL9708912 | 0.64 | ALDH1A1 (0.55) | ALDH1A1POLBRXFP1KDM4ECYP3A4 | |
| SCHEMBL414535 | 0.61 | ALDH1A1 (1.00) | ALDH1A1POLBRXFP1KDM4ECYP3A4 | |
| SCHEMBL5752168 | 0.60 | — | — | |
| SCHEMBL5752165 | 0.60 | — | — | |
| SCHEMBL158472 | 0.58 | ALDH1A1 (0.32) | ALDH1A1POLBRXFP1ATIC |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1763530-A1 | IMIDAZOPYRIDAZINE DIONES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT | Boehringer Ingelheim International GmbH (DE) | 2007-03-21 | — | — | EP | claimed |
| WO-2005087774-A1 | IMIDAZOPYRIDAZINE DIONES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2005-09-22 | — | — | WO | claimed |
| JP-4235988-A | — | — | None | — | — | JP | disclosed |
| EP-1763530-A1 | IMIDAZOPYRIDAZINE DIONES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT | Boehringer Ingelheim International GmbH (DE) | 2007-03-21 | — | — | EP | disclosed |
| WO-2005087774-A1 | IMIDAZOPYRIDAZINE DIONES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2005-09-22 | — | — | WO | disclosed |
| JP-H04235988-A | IMIDAZOPYRIDAZINEDIODE DERIVATIVE | SANKYO CO LTD | 1992-08-25 | — | — | JP | disclosed |