Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHA2 | P29317 | 4/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.44 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.42 |
| ▸ | NMT2 | O60551 | 1/20 | 0.42 |
| ▸ | NMT1 | P30419 | 1/20 | 0.42 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | BUB1 | O43683 | 1/20 | 0.41 |
| ▸ | CSF1R | P07333 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.37 |
| ▸ | P2RX2 | Q9UBL9 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27649066 | 0.84 | NMT2 (0.51) | EPHA2ERBB2EPHB4NMT2NMT1 | |
| SCHEMBL5292472 | 0.82 | EPHA2 (0.43) | EPHA2ERBB2EPHB4PDK1CSF1R | |
| SCHEMBL5297191 | 0.82 | EPHA2 (0.43) | EPHA2ERBB2EPHB4PDK1CSF1R | |
| SCHEMBL1473383 | 0.82 | EPHA2 (0.43) | EPHA2ERBB2EPHB4PDK1CSF1R | |
| SCHEMBL28851224 | 0.79 | EPHA2 (0.51) | EPHA2ERBB2EPHB4PDK1NR1H4 | |
| SCHEMBL1473531 | 0.78 | KDM4E (0.47) | EPHA2ERBB2EPHB4ALDH1A1 | |
| SCHEMBL8251140 | 0.78 | KDM4E (0.47) | EPHA2ERBB2EPHB4ALDH1A1 | |
| SCHEMBL1922160 | 0.76 | SLC6A2 (0.52) | EPHA2ERBB2EPHB4PDK1NR1H4 | |
| SCHEMBL13482008 | 0.76 | EPHA2 (0.51) | EPHA2ERBB2EPHB4PDK1NR1H4 | |
| SCHEMBL30725419 | 0.76 | BACE1 (0.49) | ALDH1A1 |
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-100469780-C | Cysteine protease inhibitors | MEDIVIR AB (SE) | 2009-03-18 | — | — | CN | disclosed |
| CN-1918169-A | Cysteine protease inhibitors | MEDIVIR AB (SE) | 2007-02-21 | — | — | CN | disclosed |