Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.49 |
| ▸ | IDH1 | O75874 | 5/20 | 0.43 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.41 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8632107 | 0.87 | AKR1C3 (0.52) | AKR1C3AKR1C2IDH1 | |
| SCHEMBL8633408 | 0.86 | ALDH1A1 (0.39) | IDH1RAB9A | |
| SCHEMBL7764117 | 0.86 | AKR1C3 (0.42) | AKR1C3AKR1C2IDH1MEN1HTT | |
| SCHEMBL8631102 | 0.85 | AKR1C3 (0.47) | AKR1C3AKR1C2IDH1KCNJ6KCNJ3 | |
| SCHEMBL8635344 | 0.84 | KMT2A (0.36) | KMT2A | |
| SCHEMBL8635463 | 0.84 | AKR1C3 (0.45) | AKR1C3AKR1C2MEN1MAPTKMT2A | |
| SCHEMBL7764901 | 0.83 | SLC9A1 (0.57) | — | |
| SCHEMBL8634936 | 0.82 | AKR1C3 (0.48) | AKR1C3AKR1C2IDH1KCNJ6KCNJ3 | |
| SCHEMBL8636256 | 0.81 | TBXA2R (0.44) | BRD4 | |
| SCHEMBL27526953 | 0.81 | RAPGEF4 (0.42) | MEN1MAPTKMT2A |
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 |