Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | STK17B | O94768 | 3/20 | 0.41 |
| ▸ | PNLIP | P16233 | 1/20 | 0.38 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | TYR | P14679 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | HTR1B | P28222 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6826531 | 1.00 | KDM4E (0.46) | KDM4EALDH1A1MAPTNPC1GAA | |
| SCHEMBL6823670 | 0.81 | STK17B (0.42) | KDM4EALDH1A1MAPTNPC1GAA | |
| SCHEMBL6824998 | 0.79 | STK17B (0.40) | STK17BPNLIPKCNA3HDAC3HDAC4 | |
| SCHEMBL6826162 | 0.78 | STK17B (0.37) | STK17BPNLIPKCNA3CSF1RKDR | |
| SCHEMBL6824994 | 0.78 | STK17B (0.40) | STK17BPNLIPKCNA3CSF1RKDR | |
| SCHEMBL6820565 | 0.77 | KCNA3 (0.36) | MAPTSMN1; SMN2STK17BPNLIPKCNA3 | |
| SCHEMBL6820563 | 0.74 | KCNA3 (0.39) | STK17BPNLIPKCNA3CSF1RKDR | |
| SCHEMBL6823667 | 0.74 | KCNA3 (0.37) | STK17BPNLIPKCNA3CSF1RKDR | |
| SCHEMBL6824996 | 0.73 | STK17B (0.36) | SMN1; SMN2STK17BPNLIPKCNA3MAOB | |
| SCHEMBL6823716 | 0.72 | KCNA3 (0.38) | STK17BKCNA3CSF1RKDRMAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004076444-A2 | NOVEL HYDROXYCOUMARANONE DERIVATIVES AS ANTITUMOR AND ANTIMETASTATIC | F. HOFFMANN-LA ROCHE AG (CH) | 2004-09-10 | — | — | WO | disclosed |