Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 3/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.35 |
| ▸ | PRKDC | P78527 | 7/20 | 0.34 |
| ▸ | SIK1 | P57059 | 1/20 | 0.34 |
| ▸ | SIK2 | Q9H0K1 | 1/20 | 0.34 |
| ▸ | SIK3 | Q9Y2K2 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.34 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21187304 | 1.00 | ERBB2 (0.35) | ERBB2PIK3CDPIK3R1PRKDCSIK1 | |
| SCHEMBL30823287 | 1.00 | ERBB2 (0.35) | ERBB2PIK3CDPIK3R1PRKDCSIK1 | |
| SCHEMBL30823286 | 0.89 | LMNA (0.41) | ERBB2PIK3CDPIK3R1PRKDCSIK1 | |
| SCHEMBL21177844 | 0.89 | LMNA (0.41) | ERBB2PIK3CDPIK3R1PRKDCSIK1 | |
| SCHEMBL21177841 | 0.89 | LMNA (0.41) | ERBB2PIK3CDPIK3R1PRKDCSIK1 | |
| SCHEMBL21187288 | 0.89 | LMNA (0.41) | ERBB2PIK3CDPIK3R1PRKDCSIK1 | |
| SCHEMBL21177861 | 0.89 | LMNA (0.41) | ERBB2PIK3CDPIK3R1PRKDCSIK1 | |
| SCHEMBL22651986 | 0.88 | ERBB2 (0.34) | ERBB2PIK3CDPIK3R1PRKDCSIK1 | |
| SCHEMBL21178290 | 0.87 | ERBB2 (0.36) | ERBB2PRKDCSIK1SIK2SIK3 | |
| SCHEMBL21187362 | 0.87 | ERBB2 (0.36) | ERBB2PRKDCSIK1SIK2SIK3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111757876-A | DNA-PK inhibitors | 沃泰克斯药物股份有限公司 | 2020-10-09 | — | — | CN | disclosed |