Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.34 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11054286 | 0.93 | HTT (0.43) | HTTALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL11049975 | 0.90 | HTT (0.48) | HTTALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL11049811 | 0.90 | MAPK1 (0.41) | HTTALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL11053331 | 0.88 | HTT (0.45) | HTTALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL11053832 | 0.88 | IDH1 (0.43) | HTTALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL11049596 | 0.87 | HTT (0.39) | HTTALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL11052568 | 0.85 | HTT (0.47) | HTTALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL11051610 | 0.85 | HTT (0.53) | HTTALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL11049751 | 0.85 | HTT (0.43) | HTTALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL11054208 | 0.84 | HTT (0.43) | HTTALDH1A1KDM4EPOLBMEN1 |
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 |