Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | PRF1 | P14222 | 3/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CTSC | P53634 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17657416 | 0.97 | PGR (0.39) | PGRPRF1CASP3HDAC3HDAC1 | |
| SCHEMBL17657444 | 0.97 | PGR (0.39) | PGRPRF1CASP3HDAC3HDAC1 | |
| SCHEMBL17657441 | 0.95 | PGR (0.37) | PGRPRF1CASP3HDAC3HDAC1 | |
| SCHEMBL17657415 | 0.89 | PGR (0.38) | PGRPRF1ALDH1A1MAPTCTSC | |
| SCHEMBL17657440 | 0.88 | PRF1 (0.36) | PGRPRF1ALDH1A1MAPTMEN1 | |
| SCHEMBL17657381 | 0.87 | PGR (0.37) | PGRPRF1CTSCPRKDC | |
| SCHEMBL17657449 | 0.86 | PGR (0.36) | PGRPRF1CTSCDRD2HTR2A | |
| SCHEMBL17657426 | 0.83 | CASP3 (0.32) | CASP3ALDH1A1MAPTMEN1HPGD | |
| SCHEMBL16546141 | 0.82 | CASP3 (0.46) | CASP3MAPTAPPPTGS2 | |
| SCHEMBL17657451 | 0.81 | CASP3 (0.31) | CASP3ALDH1A1MAPTMEN1HPGD |
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-20170092865-A1 | N-TYPE ORGANIC SEMICONDUCTOR FORMULATIONS AND DEVICES | YUNING LI (CA) | 2017-03-30 | — | — | US | disclosed |
| US-20160099412-A1 | N-TYPE ORGANIC SEMICONDUCTOR FORMULATIONS AND DEVICES | LI YUNING (CA) | 2016-04-07 | — | — | US | disclosed |