Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 2/20 | 0.55 |
| ▸ | CDC25B | P30305 | 1/20 | 0.55 |
| ▸ | CASP6 | P55212 | 1/20 | 0.55 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.55 |
| ▸ | APAF1 | O14727 | 1/20 | 0.47 |
| ▸ | METAP2 | P50579 | 1/20 | 0.46 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.41 |
| ▸ | PIM1 | P11309 | 2/20 | 0.41 |
| ▸ | FLT3 | P36888 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | PAK4 | O96013 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.41 |
| ▸ | CSF1R | P07333 | 1/20 | 0.41 |
| ▸ | RET | P07949 | 1/20 | 0.41 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL392734 | 0.81 | GAA (0.59) | TDP2CDC25BCASP6PPP1CAAPAF1 | |
| SCHEMBL1818129 | 0.78 | KDM4E (0.60) | TDP2CDC25BCASP6APAF1GAA | |
| SCHEMBL12302517 | 0.77 | TDP2 (0.49) | TDP2CDC25BCASP6PPP1CAAPAF1 | |
| SCHEMBL24801287 | 0.77 | TDP2 (0.49) | TDP2CDC25BCASP6PPP1CAAPAF1 | |
| SCHEMBL26126207 | 0.72 | CDC25B (1.00) | TDP2CDC25BCASP6PPP1CAAPAF1 | |
| SCHEMBL14927075 | 0.72 | KDM4E (0.41) | GAAMAPTNPSR1TYMSHPGD | |
| SCHEMBL7588 | 0.72 | AHR (0.53) | TDP2CDC25BCASP6PPP1CAMETAP2 | |
| SCHEMBL21812417 | 0.70 | CYP19A1 (0.55) | METAP2CHEK1PIM1FLT3AURKA | |
| SCHEMBL29735151 | 0.69 | METAP2 (0.56) | TDP2CDC25BCASP6PPP1CAAPAF1 | |
| SCHEMBL396016 | 0.69 | METAP2 (0.56) | TDP2CDC25BCASP6PPP1CAAPAF1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115572262-A | Isoquinoline derivative and preparation method thereof | 厦门沃克沃德医药科技有限公司 | 2023-01-06 | — | — | CN | disclosed |
| EP-3920922-A1 | DIHYDROOROTATE DEHYDROGENASE INHIBITORS | Janssen Biotech, Inc. (US) | 2021-12-15 | — | — | EP | disclosed |
| WO-2020161663-A1 | DIHYDROOROTATE DEHYDROGENASE INHIBITORS | JANSSEN BIOTECH, INC. (US) | 2020-08-13 | — | — | WO | disclosed |