Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.43 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21845661 | 0.84 | PDK2 (0.52) | PDK2PTGS1PTGS2MAPTCXCR1 | |
| SCHEMBL1552743 | 0.82 | PDK2 (0.66) | PDK2MAPTALDH1A1ATMTDP1 | |
| SCHEMBL133477 | 0.82 | PDK2 (0.66) | PDK2MAPTALDH1A1ATMTDP1 | |
| SCHEMBL18900478 | 0.78 | PDK2 (0.41) | PDK2PTGS1PTGS2MAPTCXCR1 | |
| SCHEMBL12337045 | 0.78 | PDK2 (0.60) | PDK2ALDH1A1ATMTDP1L3MBTL1 | |
| SCHEMBL4403150 | 0.78 | CNR2 (0.55) | PDK2ALDH1A1ATMTDP1L3MBTL1 | |
| SCHEMBL134285 | 0.76 | PDK2 (0.58) | PDK2ATMTDP1L3MBTL1 | |
| SCHEMBL29114 | 0.76 | PDK2 (0.58) | PDK2ATMTDP1L3MBTL1 | |
| SCHEMBL134286 | 0.76 | PDK2 (0.58) | PDK2ATMTDP1L3MBTL1 | |
| SCHEMBL13702055 | 0.75 | PDK2 (0.57) | PDK2ATMTDP1L3MBTL1PTPRC |
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-20110108818-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE | MERCK PATENT GMBH (DE) | 2011-05-12 | — | — | US | disclosed |
| US-20110108818-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE | MERCK PATENT GMBH (DE) | 2011-05-12 | — | — | US | disclosed |