Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 5/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13325745 | 0.75 | RAB9A (0.60) | NPC1MAPK1KDM4EALDH1A1HPGD | |
| SCHEMBL4938141 | 0.75 | DYRK1A (0.36) | NPC1MAPK1TGFBR1KDM4EALDH1A1 | |
| SCHEMBL1202800 | 0.74 | ALDH1A1 (0.49) | NPC1KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL31540362 | 0.71 | KDM4E (0.50) | NPC1MAPK1TGFBR1KDM4EALDH1A1 | |
| SCHEMBL24697495 | 0.71 | KDM4E (0.50) | NPC1MAPK1TGFBR1KDM4EALDH1A1 | |
| SCHEMBL28615697 | 0.70 | NPC1 (0.58) | TLR8NPC1MAPK1KDM4EALDH1A1 | |
| SCHEMBL13454263 | 0.70 | RAB9A (0.53) | NPC1MAPK1KDM4EALDH1A1HPGD | |
| SCHEMBL14198210 | 0.68 | ALDH1A1 (0.51) | HTR2CNPC1MAPK1TGFBR1NISCH | |
| SCHEMBL19305211 | 0.68 | KDM4E (0.33) | NPC1TGFBR1KDM4EALDH1A1HPGD | |
| SCHEMBL2066202 | 0.67 | NPC1 (0.37) | NPC1TGFBR1KDM4E |
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-2563792-A1 | IMIDAZOPYRIDAZINYL COMPOUNDS AND THEIR USES FOR CANCER | Bristol-Myers Squibb Company (US) | 2013-03-06 | — | — | EP | disclosed |
| WO-2011137155-A1 | IMIDAZOPYRIDAZINYL COMPOUNDS AND THEIR USES FOR CANCER | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-11-03 | — | — | WO | disclosed |