Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HCAR1 | Q9BXC0 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 8/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.30 |
| ▸ | PAK2 | Q13177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11059128 | 0.92 | KCNH2 (0.37) | KMT2AHCAR1KCNH2SCN5AALDH1A1 | |
| SCHEMBL11050195 | 0.88 | HCAR1 (0.39) | HCAR1CHRNA7 | |
| SCHEMBL11059212 | 0.87 | HCAR1 (0.38) | KMT2AMEN1HCAR1KCNH2SCN5A | |
| SCHEMBL11052210 | 0.86 | CDK4 (0.37) | KMT2AMEN1HCAR1CHRNA7ALDH1A1 | |
| SCHEMBL11056523 | 0.84 | MEN1 (0.33) | KMT2AMEN1HCAR1CHRNA7CYP1A2 | |
| SCHEMBL11057088 | 0.84 | MEN1 (0.37) | KMT2AMEN1 | |
| SCHEMBL11057671 | 0.84 | KMT2A (0.42) | KMT2AMEN1CHRNA7ALDH1A1 | |
| SCHEMBL11057092 | 0.82 | CHRNA7 (0.44) | HCAR1CHRNA7 | |
| SCHEMBL11056492 | 0.82 | KMT2A (0.37) | KMT2AMEN1HCAR1CHRNA7ALDH1A1 | |
| SCHEMBL11059651 | 0.81 | HCAR1 (0.44) | HCAR1KCNH2SCN5AALDH1A1TP53 |
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-4452980-A | DIARRHEA | WILLIAM H. RORER, INC. (US) | 1984-06-05 | — | — | US | disclosed |
| US-4246409-A | ANTIDIARRHEAL AGENTS | WILLIAM H. RORER, INC. (US) | 1981-01-20 | — | — | US | disclosed |
| US-4225315-A | Triazinones from amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-09-30 | — | — | US | disclosed |