Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PYGL | P06737 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 2/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.34 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7069337 | 0.84 | KEAP1 (0.46) | HPGDTSHRHSD17B10PYGLKEAP1 | |
| SCHEMBL6284961 | 0.79 | RAB9A (0.46) | HPGDPYGLPOLBMAPTALDH1A1 | |
| SCHEMBL9618645 | 0.78 | HSP90AA1 (0.40) | HPGDTSHRHSD17B10HSP90AA1POLB | |
| SCHEMBL18013115 | 0.76 | KEAP1 (0.46) | HPGDTSHRHSD17B10PYGLKEAP1 | |
| SCHEMBL30471619 | 0.74 | CES2 (0.43) | HPGDCES2CES1KEAP1NFE2L2 | |
| SCHEMBL21239984 | 0.74 | CES2 (0.43) | HPGDCES2CES1KEAP1NFE2L2 | |
| SCHEMBL9617792 | 0.74 | CA12 (0.44) | HPGDTSHRPOLBAPEX1CA2 | |
| SCHEMBL23706639 | 0.72 | PYGL (0.50) | HPGDTSHRHSD17B10PYGLKEAP1 | |
| SCHEMBL18893969 | 0.71 | HSD17B10 (0.55) | HPGDTSHRHSD17B10HSP90AA1POLB | |
| SCHEMBL7840274 | 0.71 | CES2 (0.50) | TSHRCES2CES1CA2CA1 |
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-1306523-A | Substituted 6-aryl-3-thioxo-5-(thi) oxo-2,3,4,5-tetrahydro-1,2,4-triazines | BASF AG (DE) | 2001-08-01 | — | — | CN | disclosed |
| EP-1077954-A1 | SUBSTITUTED 6-ARYL-3-THIOXO-5-(THI)OXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINES | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999059983-A1 | SUBSTITUTED 6-ARYL-3-THIOXO-5-(THI)OXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINES | BASF AKTIENGESELLSCHAFT (DE) | 1999-11-25 | — | — | WO | disclosed |