Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 2/20 | 0.51 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.51 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.51 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | LCK | P06239 | 3/20 | 0.48 |
| ▸ | FYN | P06241 | 1/20 | 0.48 |
| ▸ | SRC | P12931 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | IDH1 | O75874 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11053827 | 0.92 | MAPK1 (0.54) | PDK1PDK2PDK3PDK4MAPK1 | |
| SCHEMBL11052129 | 0.90 | POLB (0.46) | MAPK1MEN1KMT2ALCKPOLB | |
| SCHEMBL11049616 | 0.86 | HTT (0.50) | PDK1PDK2PDK3PDK4MAPK1 | |
| SCHEMBL11060189 | 0.86 | POLB (0.53) | PDK1PDK2PDK3PDK4GAA | |
| SCHEMBL11049761 | 0.85 | MAPK1 (0.48) | PDK1PDK2PDK3PDK4MAPK1 | |
| SCHEMBL11056782 | 0.85 | MAPK1 (0.48) | PDK1PDK2PDK3PDK4MAPK1 | |
| SCHEMBL11054677 | 0.85 | LMNA (0.40) | PDK1PDK2PDK3PDK4MAPK1 | |
| SCHEMBL11579856 | 0.84 | MAPK1 (0.47) | PDK1PDK2PDK3PDK4MAPK1 | |
| SCHEMBL11255736 | 0.84 | HTT (0.41) | PDK1PDK2PDK3PDK4MAPK1 | |
| SCHEMBL11578638 | 0.84 | KMT2A (0.40) | MAPK1MEN1KMT2ALCKFYN |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4488993-A | Amidinoureas | WILLIAM H. RORER, INC. | 1984-12-18 | — | — | US | disclosed |
| US-4220658-A | Treatment of hypertension with amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-09-02 | — | — | US | disclosed |
| US-4088785-A | HYPOTENSIVE AGENTS | WILLIAM H. RORER, INC. (US) | 1978-05-09 | — | — | US | disclosed |