Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 9/20 | 0.45 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.37 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.37 |
| ▸ | ATP1A3 | P13637 | 1/20 | 0.37 |
| ▸ | ATP1B2 | P14415 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3388523 | 0.83 | BRD4 (0.49) | TGFBR1RXRARXRBRXRG | |
| SCHEMBL3418697 | 0.81 | TGFBR1 (0.42) | TGFBR1FLT3GSK3BPIK3CA | |
| SCHEMBL27906803 | 0.79 | TGFBR1 (0.53) | TGFBR1PIK3CDFLT3GSK3BABCB1 | |
| SCHEMBL3433216 | 0.77 | PSEN1 (0.46) | TGFBR1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL24686234 | 0.76 | TGFBR1 (0.50) | TGFBR1PIK3CDFLT3GSK3BABCB1 | |
| SCHEMBL8337311 | 0.73 | NPC1 (0.52) | TGFBR1FLT3GSK3B | |
| SCHEMBL21508010 | 0.73 | OGA (0.41) | TGFBR1PIK3CDPIK3CA | |
| SCHEMBL3390623 | 0.71 | ALK (0.55) | TGFBR1GSK3BABCB1ABCC1ABCG2 | |
| SCHEMBL2210935 | 0.71 | TYR (0.47) | — | |
| Tannin Pyrogallol SCHEMBL29187614 | 0.71 | PTGS2 (0.52) | RXRARXRBRXRG |
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-2010052448-A2 | FUSED PYRAZINE DERIVATIVES AS KINASE INHIBITORS | UCB PHARMA S.A. (BE) | 2010-05-14 | — | — | WO | disclosed |