Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.38 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.36 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11056102 | 0.86 | HTT (0.36) | HTTPOLBKDM4EALDH1A1KMT2A | |
| SCHEMBL11052114 | 0.86 | PDK1 (0.50) | HTTPOLBKDM4EALDH1A1KMT2A | |
| SCHEMBL11052830 | 0.85 | POLB (0.58) | HTTPOLBKDM4EALDH1A1KMT2A | |
| SCHEMBL11053772 | 0.85 | HTT (0.38) | HTTPOLBKMT2AMEN1MAPK1 | |
| SCHEMBL11053656 | 0.85 | HTT (0.50) | HTTPOLBKDM4EALDH1A1KMT2A | |
| SCHEMBL11053662 | 0.84 | NPC1 (0.49) | HTTPOLBKDM4EALDH1A1KMT2A | |
| SCHEMBL11055981 | 0.84 | RAB9A (0.44) | HTTPOLBKDM4EALDH1A1KMT2A | |
| SCHEMBL11056677 | 0.84 | HTT (0.46) | HTTPOLBKDM4EALDH1A1KMT2A | |
| SCHEMBL11053981 | 0.84 | PDK1 (0.50) | HTTPOLBKDM4EALDH1A1KMT2A | |
| SCHEMBL11263600 | 0.83 | GAA (0.48) | HTTPOLBALDH1A1KMT2AMEN1 |
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 |