Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.37 |
| ▸ | PIK3C2B | O00750 | 2/20 | 0.37 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | F7 | P08709 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8342163 | 0.92 | SERPINE1 (0.37) | ALDH1A1TSHRSMN1; SMN2TP53MAPT | |
| SCHEMBL8344989 | 0.87 | ALDH1A1 (0.41) | ALDH1A1TSHRGAASMN1; SMN2TP53 | |
| SCHEMBL8342512 | 0.86 | WDR5 (0.32) | SERPINE1 | |
| SCHEMBL8346017 | 0.86 | SERPINE1 (0.53) | ALDH1A1TSHRMAPTLMNASERPINE1 | |
| SCHEMBL8119139 | 0.81 | ALDH1A1 (0.39) | ALDH1A1GAASMN1; SMN2TP53MAPT | |
| SCHEMBL8344986 | 0.76 | SMN1; SMN2 (0.38) | ALDH1A1TSHRGAASMN1; SMN2TP53 | |
| SCHEMBL8098272 | 0.75 | UBE2M (0.34) | POLBNPSR1 | |
| SCHEMBL8083716 | 0.74 | AKR1C3 (0.37) | ALDH1A1SMN1; SMN2TP53MAPTKDM4E | |
| SCHEMBL8044678 | 0.73 | KDM4E (0.45) | ALDH1A1TSHRGAASMN1; SMN2LMNA | |
| SCHEMBL8083652 | 0.73 | PPARG (0.36) | MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5955461-A | Quinoxalinedione derivatives, their production and use in pharmaceutical agents | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-09-21 | — | — | US | disclosed |
| US-5750525-A | Quinoxalinedione derivatives, their production and use in pharmaceutical agents | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-05-12 | — | — | US | disclosed |