Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 2/20 | 0.42 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CD38 | P28907 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13355461 | 0.85 | CNR1 (0.46) | CNR1TAS1R3TAS1R1ALDH1A1L3MBTL1 | |
| SCHEMBL13355291 | 0.81 | CD38 (0.51) | CNR1ALDH1A1L3MBTL1NAMPTFGFR3 | |
| SCHEMBL13355302 | 0.79 | NPC1 (0.48) | CNR1ALDH1A1NAMPTCYP1A2CYP3A4 | |
| SCHEMBL13355304 | 0.74 | NOS2 (0.47) | ALDH1A1L3MBTL1NAMPTPDE10AKMT2A | |
| SCHEMBL13355301 | 0.74 | CD38 (0.50) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE10A | |
| SCHEMBL13355464 | 0.74 | CD38 (0.49) | CNR1ALDH1A1L3MBTL1NAMPTFGFR3 | |
| SCHEMBL13355298 | 0.72 | NOS2 (0.46) | CNR1NAMPTPDE10ACD38 | |
| SCHEMBL13355299 | 0.71 | CD38 (0.55) | CNR1ALDH1A1L3MBTL1NAMPTFGFR3 | |
| SCHEMBL13355296 | 0.70 | CD38 (0.49) | CNR1ALDH1A1L3MBTL1NAMPTFGFR3 | |
| SCHEMBL13355300 | 0.69 | CD38 (0.37) | FGFR3KDRCYP3A4PDE10ACD38 |
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-2010057101-A2 | COMPOUNDS USEFUL AS HIV BLOCKERS | SCHERING CORPORATION (US) | 2010-05-20 | — | — | WO | disclosed |