Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 4/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.51 |
| ▸ | GFER | P55789 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | IDH1 | O75874 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8634936 | 0.87 | AKR1C3 (0.48) | AKR1C3AKR1C2SMN1; SMN2MEN1LMNA | |
| SCHEMBL8635178 | 0.87 | AKR1C3 (0.48) | AKR1C3AKR1C2GFERNPC1GAA | |
| SCHEMBL8635252 | 0.85 | AKR1C3 (0.50) | AKR1C3AKR1C2GFERNPC1PTGS1 | |
| SCHEMBL8635463 | 0.84 | AKR1C3 (0.45) | AKR1C3AKR1C2GFERGAAMEN1 | |
| SCHEMBL7761235 | 0.84 | SLC9A1 (0.55) | — | |
| SCHEMBL8632908 | 0.84 | PTGS1 (0.43) | GAAPTGS1SMN1; SMN2MEN1LMNA | |
| SCHEMBL8635174 | 0.81 | AKR1C3 (0.49) | AKR1C3AKR1C2GAAPTGS1SMN1; SMN2 | |
| SCHEMBL8632107 | 0.81 | AKR1C3 (0.52) | AKR1C3AKR1C2RAPGEF4IDH1 | |
| SCHEMBL8634318 | 0.81 | PDE4B (0.46) | PTGS1MEN1KMT2APDE4BMAPT | |
| SCHEMBL8633408 | 0.80 | ALDH1A1 (0.39) | NPC1PTGS1SMN1; SMN2IDH1RAB9A |
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 |