Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 8/20 | 0.55 |
| ▸ | NAT1 | P18440 | 3/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.41 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.41 |
| ▸ | MYC | P01106 | 1/20 | 0.40 |
| ▸ | MAX | P61244 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL8177697 | 1.00 | TDP1 (0.55) | TDP1NAT1PDE4BPIM1GSK3B | |
| SCHEMBL8227840 | 0.88 | TDP1 (0.72) | TDP1PIM1MEN1ALDH1A1GAA | |
| SCHEMBL8227838 | 0.88 | TDP1 (0.72) | TDP1PIM1MEN1ALDH1A1GAA | |
| SCHEMBL8176867 | 0.83 | TDP1 (0.77) | TDP1NAT1PIM1MYCMAX | |
| SCHEMBL8176862 | 0.83 | TDP1 (0.77) | TDP1NAT1PIM1MYCMAX | |
| SCHEMBL8192000 | 0.76 | NAT1 (0.74) | TDP1NAT1PDE4BPIM1GSK3B | |
| SCHEMBL8192006 | 0.76 | NAT1 (0.74) | TDP1NAT1PDE4BPIM1GSK3B | |
| SCHEMBL18103098 | 0.71 | NAT1 (0.68) | TDP1NAT1PDE4BPIM1GSK3B | |
| SCHEMBL14860995 | 0.71 | TDP1 (1.00) | TDP1MEN1ALDH1A1GAAMAPT | |
| SCHEMBL14860997 | 0.71 | TDP1 (1.00) | TDP1MEN1ALDH1A1GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000018748-A1 | RHODANINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS | ROCHE DIAGNOSTICS GMBH (DE) | 2000-04-06 | — | — | WO | disclosed |