Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | PNMT | P11086 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | CASP7 | P55210 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | KDM1A | O60341 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3832960 | 0.84 | PNMT (0.46) | PNMTKDM1A | |
| SCHEMBL5752287 | 0.81 | PNMT (0.42) | PNMTHSD17B10 | |
| SCHEMBL29754050 | 0.81 | CA9 (0.42) | BRD4ATAD2GRIN2BCRBNNR1H2 | |
| SCHEMBL6627874 | 0.78 | NR1H2 (0.45) | BRD4ATAD2GRIN2BHSD17B3CRBN | |
| SCHEMBL31370224 | 0.71 | EGLN1 (0.44) | BRD4ATAD2SCN3A | |
| SCHEMBL28947577 | 0.70 | ESR1 (0.52) | BRD4ATAD2NR1H2 | |
| SCHEMBL4564040 | 0.70 | PNMT (0.40) | BRD4ATAD2GRIN2BHSD17B3CA9 | |
| SCHEMBL5732501 | 0.70 | DRD2 (0.33) | KDM1A | |
| SCHEMBL5732466 | 0.69 | MTNR1A (0.47) | — | |
| SCHEMBL17797701 | 0.69 | GRIN2B (0.39) | GRIN2BCA9HSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2102171-A1 | NEW PYRIDAZINE DERIVATIVES WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS | Boehringer Ingelheim International GmbH (DE) | 2009-09-23 | — | — | EP | disclosed |
| WO-2008071646-A1 | NEW PYRIDAZINE DERIVATIVES WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-06-19 | — | — | WO | disclosed |