Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.52 |
| ▸ | PPARA | Q07869 | 1/20 | 0.52 |
| ▸ | THRA | P10827 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | ADRB2 | P07550 | 5/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 9/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GGT1 | P19440 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19181639 | 0.90 | THRA (0.51) | PPARGPPARATHRATHRBADRB2 | |
| SCHEMBL10599953 | 0.88 | THRA (0.50) | PPARGPPARATHRATHRBADRB2 | |
| SCHEMBL28397408 | 0.88 | THRA (0.50) | PPARGPPARATHRATHRBADRB2 | |
| SCHEMBL28914172 | 0.88 | PTGS2 (0.46) | PPARGPPARATHRATHRBPTGS2 | |
| SCHEMBL16065424 | 0.87 | PPARG (0.59) | PPARGPPARATHRATHRBPTGS2 | |
| Acetic Acid SCHEMBL9302793 | 0.85 | THRA (0.44) | PPARGPPARATHRATHRBADRB2 | |
| SCHEMBL247213 | 0.83 | THRA (0.46) | PPARGPPARATHRATHRBADRB2 | |
| SCHEMBL3043813 | 0.83 | PPARA (0.72) | PPARGPPARATHRATHRBPTGS2 | |
| SCHEMBL28569965 | 0.83 | PPARA (0.72) | PPARGPPARATHRATHRBPTGS2 | |
| SCHEMBL7637671 | 0.83 | PPARA (0.72) | PPARGPPARATHRATHRBPTGS2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0923532-B1 | ESTERIFICATION OF PHENOLS | COGNIS CORP (US) | 2002-09-04 | — | — | EP | disclosed |
| EP-0923532-A4 | ESTERIFICATION OF PHENOLS | HENKEL CORP (US) | 1999-09-15 | — | — | EP | disclosed |
| EP-0923532-A1 | ESTERIFICATION OF PHENOLS | HENKEL CORPORATION (US) | 1999-06-23 | — | — | EP | disclosed |
| US-5808130-A | REACTION WITH CARBOXYLIC ACID OR ANHYDRIDE, STRONG ACID CATALYST, RECYCLING ACID | HENKEL CORPORATION (US) | 1998-09-15 | — | — | US | disclosed |
| WO-1997049663-A1 | ESTERIFICATION OF PHENOLS | HENKEL CORPORATION (US) | 1997-12-31 | — | — | WO | disclosed |