Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1727199 | 0.91 | ALDH1A1 (0.45) | ALDH1A1HCAR3MITFCDC25BPOLB | |
| SCHEMBL1727200 | 0.91 | ALDH1A1 (0.45) | ALDH1A1HCAR3MITFCDC25BPOLB | |
| SCHEMBL9897509 | 0.90 | ALDH1A1 (0.49) | ALDH1A1MITFHTTHPGD | |
| SCHEMBL9897513 | 0.90 | ALDH1A1 (0.49) | ALDH1A1MITFHTTHPGD | |
| SCHEMBL9899508 | 0.89 | PTGES (0.44) | ALDH1A1HCAR3MITFCDC25BPOLB | |
| SCHEMBL9899506 | 0.89 | PTGES (0.44) | ALDH1A1HCAR3MITFCDC25BPOLB | |
| SCHEMBL27924938 | 0.85 | ALDH1A1 (0.40) | ALDH1A1HCAR3MITFCDC25BPOLB | |
| SCHEMBL9898930 | 0.84 | ALDH1A1 (0.45) | ALDH1A1MITFPOLBL3MBTL1HPGD | |
| SCHEMBL9898933 | 0.84 | ALDH1A1 (0.45) | ALDH1A1MITFPOLBL3MBTL1HPGD | |
| SCHEMBL9899352 | 0.84 | PTGES (0.43) | ALDH1A1POLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012076673-A1 | 6-AMINO-2-PHENYLAMINO-1H-BENZIMIDAZOLE-5-CARBOXAMIDE- DERIVATIVES AND THEIR USE AS MICROSOMAL PROSTAGLANDIN E2 SYNTHASE-1 INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-06-14 | — | — | WO | disclosed |