Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 3/20 | 0.61 |
| ▸ | METAP1 | P53582 | 3/20 | 0.61 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.54 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.54 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.51 |
| ▸ | ATR | Q13535 | 2/20 | 0.50 |
| ▸ | CSNK1D | P48730 | 5/20 | 0.49 |
| ▸ | CSNK1A1 | P48729 | 4/20 | 0.49 |
| ▸ | CSNK1G2 | P78368 | 4/20 | 0.49 |
| ▸ | GSK3B | P49841 | 3/20 | 0.49 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.49 |
| ▸ | DGAT1 | O75907 | 3/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.48 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | CBFB | Q13951 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL902859 | 0.80 | ADORA3 (0.63) | METAP2METAP1DGAT1KCNH2CBFB | |
| SCHEMBL10188888 | 0.79 | PKN1 (0.51) | METAP2METAP1PKN1PKN2CHEK2 | |
| SCHEMBL13286844 | 0.77 | NPC1 (0.57) | METAP2METAP1CBFBNPC1PKM | |
| SCHEMBL6061287 | 0.76 | PKN1 (0.65) | METAP2METAP1PKN1PKN2CHEK2 | |
| SCHEMBL902815 | 0.75 | CBFB (0.64) | ATRDGAT1CBFB | |
| SCHEMBL20982510 | 0.75 | PKN1 (0.82) | METAP2METAP1PKN1PKN2CHEK2 | |
| SCHEMBL10189650 | 0.75 | METAP2 (0.47) | METAP2METAP1PKN1PKN2CHEK2 | |
| SCHEMBL18764054 | 0.75 | CHEK2 (0.78) | METAP2METAP1PKN1PKN2CHEK2 | |
| SCHEMBL34849 | 0.75 | ADORA3 (0.47) | METAP2METAP1ADORA2ACBFBNPC1 | |
| SCHEMBL12430878 | 0.74 | CSNK1D (0.61) | METAP2METAP1PKN1PKN2CHEK2 |
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-2012044567-A2 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |