Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.35 |
| ▸ | APP | P05067 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5265280 | 1.00 | PIN1 (0.36) | PIN1HIF1AAPPALDH1A1BCHE | |
| SCHEMBL5361261 | 0.85 | APP (0.33) | PIN1APPBCHEACHETP53 | |
| SCHEMBL5265501 | 0.85 | PIN1 (0.38) | PIN1HIF1AAPPALDH1A1BCHE | |
| SCHEMBL18427307 | 0.85 | PIN1 (0.38) | PIN1HIF1AAPPALDH1A1BCHE | |
| SCHEMBL5268318 | 0.85 | PIN1 (0.38) | PIN1HIF1AAPPALDH1A1BCHE | |
| SCHEMBL3668993 | 0.83 | PIN1 (0.39) | PIN1HIF1AAPPALDH1A1BCHE | |
| SCHEMBL3669336 | 0.83 | PIN1 (0.39) | PIN1HIF1AAPPALDH1A1BCHE | |
| SCHEMBL3932082 | 0.83 | STING1 (0.41) | HIF1AAPPALDH1A1EGFRPDE4A | |
| SCHEMBL5264653 | 0.80 | STING1 (0.44) | PIN1HIF1AALDH1A1MAPTPDE4A | |
| SCHEMBL14408042 | 0.79 | APP (0.39) | PIN1HIF1AAPPALDH1A1BCHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1317437-B1 | SYNTHESIS OF 4-ALPHA-ARYLEPICATECHINS | MARS INC (US) | 2007-10-03 | — | — | EP | claimed |
| US-6476241-B1 | Synthesis of 4α-arylepicatechins | MARS INCORPORATED | 2002-11-05 | — | — | US | claimed |
| EP-1317437-B1 | SYNTHESIS OF 4-ALPHA-ARYLEPICATECHINS | MARS INC (US) | 2007-10-03 | — | — | EP | disclosed |