Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GDA | Q9Y2T3 | 3/20 | 0.53 |
| ▸ | PNP | P00491 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | BLM | P54132 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10998 | 1.00 | GDA (0.53) | GDAPNPMEN1KMT2APMP22 | |
| 7-Methylxanthine SCHEMBL2466924 | 0.87 | GDA (0.77) | GDAPNPMEN1KMT2APMP22 | |
| Caffeine SCHEMBL1044373 | 0.82 | ADORA2B (0.64) | GDAPMP22CYP3A4MAPK1BLM | |
| SCHEMBL15290224 | 0.81 | ALDH1A1 (0.56) | GDAPNPMEN1KMT2APMP22 | |
| SCHEMBL4379221 | 0.81 | KMT2A (0.45) | GDAPNPMEN1KMT2APMP22 | |
| SCHEMBL2352519 | 0.80 | PNP (0.43) | GDAPNPMEN1KMT2APMP22 | |
| Theophylline Anhydrous SCHEMBL8524559 | 0.79 | ATAD2 (0.62) | CYP3A4MAPK1LMNAMAPTTSHR | |
| SCHEMBL5054173 | 0.78 | PNP (0.54) | GDAPNPMEN1KMT2AALDH1A1 | |
| SCHEMBL618978 | 0.77 | PNP (0.44) | GDAPNPMEN1KMT2APMP22 | |
| SCHEMBL133948 | 0.77 | PNP (0.41) | GDAPNPMEN1KMT2APMP22 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7557175-B2 | Poly(carbonate-co-urea) copolymers and melt transesterification method of preparing these copolymers | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2009-07-07 | — | — | US | disclosed |