Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 8/20 | 0.56 |
| ▸ | RORB | Q92753 | 1/20 | 0.48 |
| ▸ | KMO | O15229 | 1/20 | 0.45 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | PRKCI | P41743 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16007627 | 0.87 | NUDT1 (0.57) | NUDT1KMOIKBKBJAK2PARP1 | |
| SCHEMBL27964788 | 0.77 | RORB (0.68) | NUDT1RORBIKBKBJAK2PARP1 | |
| SCHEMBL17244329 | 0.74 | GABRA1 (0.51) | NUDT1RORBKMOIKBKBPARP1 | |
| SCHEMBL22976600 | 0.73 | NTRK1 (0.39) | CNR2 | |
| SCHEMBL15638246 | 0.72 | RORB (0.46) | NUDT1RORBJAK2MAP4K4 | |
| SCHEMBL28143127 | 0.71 | CDC7 (0.46) | NUDT1IKBKBADORA2A | |
| SCHEMBL7083955 | 0.70 | KDM4E (0.48) | NUDT1RORBKMOPARP1ADORA2A | |
| SCHEMBL4026009 | 0.70 | PARP1 (0.52) | NUDT1RORBIKBKBJAK2PARP1 | |
| SCHEMBL11902083 | 0.69 | MAP4K4 (0.56) | NUDT1MAP4K4TDO2ADORA2AADORA1 | |
| SCHEMBL3632126 | 0.69 | BCAT2 (0.65) | NUDT1RORBIKBKBJAK2PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103827089-A | Novel compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same | BORYUNG PHARM | 2014-05-28 | — | — | CN | disclosed |