Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 6/20 | 0.40 |
| ▸ | CA2 | P00918 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | PLG | P00747 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | PLAT | P00750 | 1/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11836176 | 0.86 | KMT2A (0.39) | KMT2AMEN1CA1CA2CYP1A2 | |
| SCHEMBL11055205 | 0.86 | F2 (0.39) | KMT2AMEN1CA1CA2CA9 | |
| SCHEMBL11051492 | 0.84 | POLB (0.44) | KMT2AMEN1CA1CA2CYP1A2 | |
| SCHEMBL11322116 | 0.83 | MAP2K2 (0.46) | KMT2AMEN1CA1CA2RAB9A | |
| SCHEMBL11315297 | 0.83 | CYP1A2 (0.43) | CA1CA2CYP1A2CA9CA12 | |
| SCHEMBL11316866 | 0.81 | RAB9A (0.58) | KMT2AMEN1RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL11407156 | 0.81 | F2 (0.36) | KMT2AMEN1CA1CA2CA9 | |
| SCHEMBL11309285 | 0.81 | NPC1 (0.43) | KMT2AMEN1CA1CA2CA9 | |
| SCHEMBL11414234 | 0.79 | MAPK1 (0.47) | KMT2AMEN1RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL11320603 | 0.78 | CA1 (0.44) | KMT2AMEN1CA1CA2CA9 |
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-4283555-A | Amidinoureas | WILLIAM H. RORER, INC. (US) | 1981-08-11 | — | — | US | disclosed |
| US-4219567-A | ANTIULCER AGENTS | WILLIAM H. RORER, INC. (US) | 1980-08-26 | — | — | US | disclosed |
| US-4183956-A | Method for treating gastrointestinal spasms, gastrointestinal hyperacidity and hypertensive disorders with amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-01-15 | — | — | US | disclosed |