Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | PRNP | P04156 | 1/20 | 0.39 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RORB | Q92753 | 2/20 | 0.38 |
| ▸ | RORC | P51449 | 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 | |
|---|---|---|---|---|
| SCHEMBL7931239 | 0.86 | AKR1C3 (0.52) | TSHRCES2CES1ALDH1A1POLB | |
| SCHEMBL2303377 | 0.84 | TSHR (0.63) | TSHRCES2CES1ALDH1A1POLB | |
| SCHEMBL7596116 | 0.84 | ALDH1A1 (0.52) | TSHRCES2CES1ALDH1A1POLB | |
| SCHEMBL5696499 | 0.83 | TSHR (0.45) | TSHRCES2CES1ALDH1A1POLB | |
| SCHEMBL5057138 | 0.79 | PTPN1 (0.50) | TSHRCES2CES1ALDH1A1POLB | |
| SCHEMBL5263107 | 0.78 | PLK1 (0.49) | TSHRCES2CES1ALDH1A1POLB | |
| SCHEMBL16981795 | 0.78 | TSHR (0.41) | TSHRCES2CES1ALDH1A1POLB | |
| SCHEMBL16984656 | 0.78 | TAS1R3 (0.41) | TSHRCES2CES1ALDH1A1POLB | |
| SCHEMBL29695689 | 0.78 | NR4A2 (0.51) | TSHRALDH1A1POLBMAPTKMT2A | |
| SCHEMBL10972982 | 0.78 | NR4A2 (0.51) | TSHRALDH1A1POLBMAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-101784266-B | Bupropion hydrobromide and therapeutic applications | BIOVAIL LAB INT SRL | 2012-07-18 | — | — | CN | disclosed |
| CN-101784266-A | The application of bupropion hydrobromide and treatment | BIOVAIL LAB INT SRL | 2010-07-21 | — | — | CN | disclosed |