Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.55 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.55 |
| ▸ | UTS2R | Q9UKP6 | 8/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 2/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.50 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | HTR1D | P28221 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1711760 | 0.87 | TAS1R3 (0.57) | SMYD3MEN1KMT2ATAS1R3TAS1R2 | |
| SCHEMBL12200364 | 0.87 | HTR4 (0.57) | SMYD3KDM4EMEN1POLBMAPT | |
| SCHEMBL28684619 | 0.84 | NPC1 (0.66) | KDM4EMEN1POLBMAPTMAPK1 | |
| SCHEMBL6824522 | 0.83 | MEN1 (0.56) | SMYD3MEN1KMT2AHDAC8 | |
| SCHEMBL6823619 | 0.83 | CNR2 (0.57) | SMYD3KDM4EPOLBMAPTKMT2A | |
| Hydrochloric Acid SCHEMBL7527565 | 0.81 | MEN1 (0.55) | SMYD3MEN1KMT2AHDAC8 | |
| SCHEMBL6824208 | 0.81 | L3MBTL1 (0.76) | MEN1KMT2A | |
| SCHEMBL3222814 | 0.81 | MAPK14 (0.58) | SMYD3MEN1KMT2A | |
| SCHEMBL5438942 | 0.80 | F10 (0.54) | SMYD3 | |
| SCHEMBL6820557 | 0.79 | TAS1R3 (0.52) | KDM4EMEN1POLBMAPTMAPK1 |
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 5 patents. 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 |
| CN-1132828-C | O-substd. hydroxy coumaranone derivs as antineoplastic and antitransfer agent | ROCH DIAGNOSIS EQUIPMENT AG (DE) | 2003-12-31 | — | — | CN | disclosed |
| US-6307051-B1 | UROKINASE-TYPE PLASMINOGEN ACTIVATOR ANTAGONISTS AND HAVE ANTITUMOR AND ANTIMETASTATIC ACTIVITY. | ROCHE DIAGNOSTICS GMBH (DE) | 2001-10-23 | — | — | US | disclosed |
| CN-1266850-A | O-substd. hydroxy coumaranone derivs as antineoplastic and antitransfer agent | ROCH DIAGNOSIS EQUIPMENT AG (DE) | 2000-09-20 | — | — | CN | disclosed |
| EP-1026165-A1 | O-substituted Hydroxycoumaranone derivatives as antitumor and antimetastatic agents | Roche Diagnostics GmbH (DE) | 2000-08-09 | — | — | EP | disclosed |