Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.46 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15225596 | 0.86 | CYP2D6 (0.41) | PTGS2PTGS1MAPTCYP3A4HPGD | |
| SCHEMBL15225780 | 0.85 | STS (0.43) | PTGS2PTGS1SMN1; SMN2HPGDALDH1A1 | |
| SCHEMBL2862917 | 0.75 | HPGD (0.40) | PTGS2SMN1; SMN2MAPTCYP3A4HPGD | |
| SCHEMBL2862066 | 0.71 | LMNA (0.40) | PTGS2SMN1; SMN2MAPTCYP3A4HPGD | |
| SCHEMBL2863503 | 0.71 | L3MBTL1 (0.40) | SMN1; SMN2MAPTCYP3A4HPGDALDH1A1 | |
| SCHEMBL28132998 | 0.70 | BCL2 (0.54) | PTGS2PTGS1MAPTCYP3A4HPGD | |
| SCHEMBL2862470 | 0.69 | HPGD (0.49) | PTGS2PTGS1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL28001032 | 0.69 | CES2 (0.44) | HPGDALDH1A1KDM4EMAPK1HSD17B10 | |
| SCHEMBL2859684 | 0.69 | GAA (0.40) | PTGS2PTGS1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL2857183 | 0.68 | L3MBTL1 (0.37) | SMN1; SMN2HPGDALDH1A1LMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1642880-B1 | HSP90 FAMILY PROTEIN INHIBITORS | KYOWA HAKKO KIRIN CO LTD (JP) | 2013-09-04 | — | — | EP | claimed |