Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 2/20 | 0.34 |
| ▸ | FYN | P06241 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11055321 | 0.92 | HTT (0.47) | HTTPOLBAPEX1KMT2AALDH1A1 | |
| SCHEMBL11049566 | 0.90 | LCK (0.40) | HTTPOLBAPEX1TSHRKMT2A | |
| SCHEMBL11052568 | 0.88 | HTT (0.47) | HTTL3MBTL1POLBAPEX1TSHR | |
| SCHEMBL11052453 | 0.88 | HTT (0.57) | HTTL3MBTL1POLBTSHRKMT2A | |
| SCHEMBL11053832 | 0.86 | IDH1 (0.43) | HTTPOLBAPEX1KMT2AALDH1A1 | |
| SCHEMBL11048657 | 0.83 | HTT (0.47) | HTTL3MBTL1POLBAPEX1TSHR | |
| SCHEMBL11053938 | 0.83 | HTT (0.47) | HTTL3MBTL1POLBAPEX1TSHR | |
| SCHEMBL11266319 | 0.82 | HTT (0.39) | HTTL3MBTL1POLBTSHRKMT2A | |
| SCHEMBL11049975 | 0.82 | HTT (0.48) | HTTL3MBTL1POLBAPEX1KMT2A | |
| SCHEMBL11252255 | 0.82 | HTT (0.40) | HTTL3MBTL1POLBAPEX1TSHR |
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-4326074-A | ANTIDIARRHEA AGENTS | WILLIAM H. RORER, INC. (US) | 1982-04-20 | — | — | US | disclosed |
| US-4220658-A | Treatment of hypertension with amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-09-02 | — | — | US | disclosed |