Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | PLEC | Q15149 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3787955 | 0.80 | ALDH1A1 (0.54) | CYP3A4ALDH1A1TSHRSMN1; SMN2ALOX15 | |
| SCHEMBL21799996 | 0.75 | MAPT (0.39) | CYP3A4ALDH1A1SMN1; SMN2ALOX15TDP1 | |
| SCHEMBL29922652 | 0.75 | MAPT (0.39) | CYP3A4ALDH1A1SMN1; SMN2ALOX15TDP1 | |
| SCHEMBL8610624 | 0.74 | ALDH1A1 (0.59) | CYP3A4ALDH1A1SMN1; SMN2TDP1MAPT | |
| SCHEMBL8611589 | 0.72 | CYP3A4 (0.42) | CYP3A4ALDH1A1TSHRSMN1; SMN2ALOX15 | |
| SCHEMBL20659812 | 0.71 | EPHX1 (0.40) | CYP3A4ALDH1A1TSHRSMN1; SMN2ALOX15 | |
| SCHEMBL9683129 | 0.70 | MAPT (0.47) | CYP3A4ALDH1A1TSHRSMN1; SMN2ALOX15 | |
| SCHEMBL419643 | 0.70 | PRSS1 (0.46) | CYP3A4ALDH1A1TSHRSMN1; SMN2ALOX15 | |
| SCHEMBL1980735 | 0.70 | ALDH1A1 (0.53) | CYP3A4ALDH1A1TSHRSMN1; SMN2ALOX15 | |
| SCHEMBL29703904 | 0.70 | ALDH1A1 (0.53) | CYP3A4ALDH1A1TSHRSMN1; SMN2ALOX15 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5852017-A | 2,3(1H,4H)-quinoxalinediones | BASF AKTIENGESELLSCHAFT (DE) | 1998-12-22 | — | — | US | disclosed |
| EP-0572852-B1 | Quinoxalin-2,3(1H,4H)-diones used as medicine | BASF AG (DE) | 1998-10-21 | — | — | EP | disclosed |
| US-5714489-A | 2,3(1H,4H)quinoxalinedione | BASF AKTIENGESELLSCHAFT (DE) | 1998-02-03 | — | — | US | disclosed |
| EP-0572852-A1 | Quinoxalin-2,3(1H,4H)-diones used as medicine | BASF Aktiengesellschaft (DE) | 1993-12-08 | — | — | EP | disclosed |