Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.47 |
| ▸ | GNAO1 | P09471 | 4/20 | 0.46 |
| ▸ | GNAI3 | P08754 | 3/20 | 0.46 |
| ▸ | GNAI1 | P63096 | 3/20 | 0.46 |
| ▸ | GLB1 | P16278 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD5 | P21918 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5119116 | 0.94 | GNAO1 (0.53) | NCF1GNAO1GNAI3GNAI1HTR1A | |
| SCHEMBL855324 | 0.89 | BCHE (0.49) | NCF1GNAO1GNAI3GNAI1BCHE | |
| SCHEMBL2007745 | 0.88 | NCF1 (0.56) | NCF1GNAO1GNAI3GNAI1KCNH2 | |
| SCHEMBL9437336 | 0.88 | NCF1 (0.50) | NCF1GNAO1GNAI3GNAI1DRD2 | |
| Hydrochloric Acid SCHEMBL6181139 | 0.86 | GNAO1 (0.56) | NCF1GNAO1GNAI3GNAI1KCNH2 | |
| SCHEMBL18290280 | 0.84 | NCF1 (0.45) | NCF1GNAO1GNAI3GNAI1SIGMAR1 | |
| SCHEMBL24134595 | 0.84 | HTR1A (0.46) | GNAO1GNAI3GNAI1GLB1HTR1A | |
| SCHEMBL15780399 | 0.84 | HTR1A (0.46) | GNAO1GNAI3GNAI1GLB1HTR1A | |
| SCHEMBL20244726 | 0.84 | GLB1 (0.52) | NCF1GNAO1GNAI3GNAI1GLB1 | |
| SCHEMBL7136176 | 0.82 | GNAO1 (0.61) | NCF1GNAO1GNAI3GNAI1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107709314-A | Efflux pump inhibitor and its therapeutic use | 巴斯利尔药物国际股份公司 | 2018-02-16 | — | — | CN | disclosed |
| EP-2640366-A2 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | Exelixis, Inc. (US) | 2013-09-25 | — | — | EP | disclosed |
| WO-2012068096-A2 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-05-24 | — | — | WO | disclosed |
| EP-2432779-A1 | BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES | Exelixis, Inc. (US) | 2012-03-28 | — | — | EP | disclosed |
| WO-2010135524-A1 | BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES | EXELIXIS, INC. (US) | 2010-11-25 | — | — | WO | disclosed |