Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | IDH1 | O75874 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8635463 | 0.87 | AKR1C3 (0.45) | AKR1C3AKR1C2MEN1KMT2AGFER | |
| SCHEMBL8632908 | 0.87 | PTGS1 (0.43) | MEN1KMT2ASMN1; SMN2LMNAPTGS1 | |
| SCHEMBL8631102 | 0.86 | AKR1C3 (0.47) | AKR1C3AKR1C2MEN1KMT2ALMNA | |
| SCHEMBL8633209 | 0.86 | MEN1 (0.43) | AKR1C3AKR1C2ADORA3ADORA2AADORA2B | |
| SCHEMBL8637536 | 0.85 | AKR1C3 (0.51) | AKR1C3AKR1C2MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL7764005 | 0.84 | SLC9A1 (0.57) | — | |
| SCHEMBL8632107 | 0.84 | AKR1C3 (0.52) | AKR1C3AKR1C2IDH1 | |
| SCHEMBL8634318 | 0.84 | PDE4B (0.46) | MEN1KMT2APTGS1PTGS2ALDH1A1 | |
| SCHEMBL8635848 | 0.81 | CYP11B2 (0.46) | MEN1KMT2ALMNAALDH1A1PDE4B | |
| SCHEMBL8633408 | 0.80 | ALDH1A1 (0.39) | SMN1; SMN2PTGS1PTGS2IDH1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1057999-C | 4-Aminobenzoylguanidine derivatives | MERCK PATENT GMBH (DE) | 2000-11-01 | — | — | CN | disclosed |
| US-5739142-A | 4-aminobenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-04-14 | — | — | US | disclosed |
| CN-1138575-A | 4-aminobenzoylguanidine derivatives | MERCK PATENT GMBH (DE) | 1996-12-25 | — | — | CN | disclosed |