Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.67 |
| ▸ | PPARD | Q03181 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | MRGPRX4 | Q96LA9 | 4/20 | 0.52 |
| ▸ | RXRA | P19793 | 3/20 | 0.50 |
| ▸ | RXRB | P28702 | 3/20 | 0.50 |
| ▸ | RXRG | P48443 | 2/20 | 0.50 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11473142 | 0.88 | PPARD (0.55) | PDK2PPARDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11470785 | 0.86 | PPARD (0.58) | PDK2PPARDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29394534 | 0.86 | PPARD (0.60) | PPARDNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL3950358 | 0.86 | PPARD (0.60) | PPARDNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL11460459 | 0.86 | PPARD (0.53) | PDK2PPARDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11460782 | 0.85 | PPARD (0.55) | PDK2PPARDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11460696 | 0.85 | PPARD (0.55) | PDK2PPARDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11465700 | 0.85 | PPARD (0.52) | PDK2PPARDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11462250 | 0.84 | PPARD (0.57) | PDK2PPARDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11462528 | 0.83 | MRGPRX4 (0.62) | PDK2PPARDNPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20040058425-A1 | Crystal structure | PFIZER INC. | 2004-03-25 | — | — | US | disclosed |
| EP-1247860-A1 | Crystal structure of pyruvate dehydrogenase kinase 2 (PDHK-2) and use thereof in methods for identifying and designing new ligands | Pfizer Limited (GB) | 2002-10-09 | — | — | EP | disclosed |
| US-4221919-A | Antiinflammatory substituted phenylacetic acids | SPOFA, UNITED PHARMACEUTICAL WORKS (CS) | 1980-09-09 | — | — | US | disclosed |