Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.48 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | GFER | P55789 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | P2RY2 | P41231 | 2/20 | 0.41 |
| ▸ | P2RY4 | P51582 | 2/20 | 0.41 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8634230 | 0.88 | AKR1C3 (0.45) | AKR1C3AKR1C2PTGS1MEN1KMT2A | |
| SCHEMBL8637536 | 0.87 | AKR1C3 (0.51) | AKR1C3AKR1C2MTNR1BMTNR1APDE4B | |
| SCHEMBL8633209 | 0.85 | MEN1 (0.43) | AKR1C3AKR1C2PDE4BPTGS1MEN1 | |
| SCHEMBL8635140 | 0.85 | BCAT2 (0.42) | AKR1C3AKR1C2MEN1KMT2AGFER | |
| SCHEMBL7768696 | 0.85 | PDE4B (0.44) | AKR1C3AKR1C2PDE4B | |
| SCHEMBL8632359 | 0.84 | MEN1 (0.44) | PTGS1MEN1KMT2ASMN1; SMN2LMNA | |
| SCHEMBL8636186 | 0.82 | AKR1C3 (0.44) | AKR1C3AKR1C2PTGS1MEN1KMT2A | |
| SCHEMBL8632259 | 0.82 | YAP1 (0.49) | AKR1C3AKR1C2LMNAHPGDGAA | |
| SCHEMBL8632351 | 0.82 | PDE4B (0.41) | PDE4BPTGS1MEN1KMT2ALMNA | |
| SCHEMBL8635300 | 0.81 | HTT (0.38) | PTGS1MAPTP2RY4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5739142-A | 4-aminobenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-04-14 | — | — | US | disclosed |