Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 6/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PDE2A | O00408 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 1/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11095111 | 0.86 | KIF11 (0.45) | KIF11CYP1A2KDM4EMEN1KMT2A | |
| SCHEMBL11095537 | 0.85 | KIF11 (0.59) | KIF11KDM4EMEN1KMT2A | |
| SCHEMBL11250280 | 0.83 | LMNA (0.41) | CYP1A2CYP2C19CYP2C9MEN1KMT2A | |
| SCHEMBL11580545 | 0.82 | ALDH1A1 (0.55) | KIF11CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL11250969 | 0.82 | TAS2R14 (0.47) | KIF11CYP1A2KDM4EMEN1KMT2A | |
| SCHEMBL11579884 | 0.82 | KIF11 (0.44) | KIF11CYP1A2CYP2C19KDM4EMEN1 | |
| SCHEMBL11259976 | 0.82 | PKM (0.48) | KIF11CYP1A2CYP2C19KDM4EMEN1 | |
| SCHEMBL23752446 | 0.80 | ALDH1A1 (0.57) | CYP1A2CYP2C19CYP2C9MEN1KMT2A | |
| SCHEMBL11252261 | 0.79 | MAPK1 (0.48) | KDM4EMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL11248235 | 0.79 | ALDH1A1 (0.42) | KDM4EMEN1KMT2AALDH1A1MAPT |
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-4326074-A | ANTIDIARRHEA AGENTS | WILLIAM H. RORER, INC. (US) | 1982-04-20 | — | — | US | disclosed |
| US-4115564-A | Treatment of diarrhea with amidinoureas | WILLIAM H. RORER, INC. (US) | 1978-09-19 | — | — | US | disclosed |
| US-4088785-A | HYPOTENSIVE AGENTS | WILLIAM H. RORER, INC. (US) | 1978-05-09 | — | — | US | disclosed |