Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | VEGFA | P15692 | 1/20 | 0.32 |
| ▸ | FLT1 | P17948 | 1/20 | 0.32 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | EGLN3 | Q9H6Z9 | 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 | |
|---|---|---|---|---|
| SCHEMBL6495822 | 0.92 | SHMT1 (0.39) | HPGDKDM4ECDC7DBF4 | |
| SCHEMBL6499174 | 0.90 | ADORA1 (0.38) | ADORA2AADORA1HPGDALDH1A1NPC1 | |
| SCHEMBL6531507 | 0.90 | PARP1 (0.36) | ADORA2AHPGDALDH1A1NPC1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL6505587 | 0.89 | PPARA (0.38) | ADORA2AADORA1HPGDALDH1A1NPC1 | |
| SCHEMBL6504395 | 0.89 | PPARA (0.37) | PPARDPPARA | |
| SCHEMBL6505045 | 0.87 | SMN1; SMN2 (0.35) | ADORA2AADORA1HPGDALDH1A1NPC1 | |
| SCHEMBL6498709 | 0.87 | CDK2 (0.34) | NPC1PPARDPPARA | |
| SCHEMBL6503597 | 0.86 | KDM4E (0.36) | ALDH1A1NPC1KDM4ERAB9APOLB | |
| SCHEMBL6494741 | 0.85 | PPARA (0.39) | ADORA2AADORA1CYP1A2CYP3A4CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL6495816 | 0.81 | SHMT1 (0.44) | PPARDPPARAKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6884821-B1 | Carboxylic acid derivatives and drugs containing the same | EISAI CO., LTD. (JP) | 2005-04-26 | — | — | US | disclosed |
| EP-1216980-A1 | CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME | Eisai Co., Ltd. (JP) | 2002-06-26 | — | — | EP | disclosed |