Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | RAPGEF4 | Q8WZA2 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11274093 | 0.85 | ALDH1A1 (0.44) | ALDH1A1RAPGEF4LMNAHPGDNLRP3 | |
| SCHEMBL11051094 | 0.84 | ALDH1A1 (0.58) | ALDH1A1LMNAHPGDCYP3A4CYP2D6 | |
| SCHEMBL11279063 | 0.84 | ALDH1A1 (0.37) | ALDH1A1RAPGEF4LMNAHPGDNLRP3 | |
| SCHEMBL11060104 | 0.84 | KDM4E (0.49) | ALDH1A1RAPGEF4LMNAKDM4EHPGD | |
| SCHEMBL11137127 | 0.84 | ALDH1A1 (0.49) | ALDH1A1RAPGEF4LMNAKDM4EHPGD | |
| SCHEMBL11271811 | 0.83 | RAPGEF4 (0.44) | ALDH1A1RAPGEF4LMNAMEN1POLB | |
| SCHEMBL11287194 | 0.81 | POLB (0.42) | ALDH1A1LMNACYP3A4MEN1POLB | |
| SCHEMBL11269802 | 0.81 | LMNA (0.44) | ALDH1A1RAPGEF4LMNAKDM4EHPGD | |
| SCHEMBL11285813 | 0.75 | HTT (0.38) | ALDH1A1LMNAHPGDMEN1POLB | |
| SCHEMBL11053068 | 0.73 | ALDH1A1 (0.45) | ALDH1A1LMNAHPGDNLRP3MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4326075-A | ANTIDIARRHEA AGENTS | WILLIAM H. RORER, INC. (US) | 1982-04-20 | — | — | US | disclosed |
| US-4203920-A | ANTIDIARRHEAL | WILLIAM H. RORER, INC. (US) | 1980-05-20 | — | — | US | disclosed |
| US-4147804-A | ANTIARRHYTHMIA AGENTS | WILLIAM H. RORER, INC. (US) | 1979-04-03 | — | — | US | disclosed |
| US-4060635-A | Amidinoureas for treating diarrhea | WILLIAM H. RORER, INC. (US) | 1977-11-29 | — | — | US | disclosed |