Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 6/20 | 0.50 |
| ▸ | FGFR1 | P11362 | 4/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.35 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.35 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1317365 | 0.73 | DHFR (0.66) | DHFRFGFR1SRCADORA2AADORA1 | |
| SCHEMBL31612551 | 0.73 | DHFR (0.61) | DHFRADORA2AADORA1KMT2A | |
| SCHEMBL29116207 | 0.73 | DHFR (0.61) | DHFRADORA2AADORA1KMT2A | |
| SCHEMBL30453734 | 0.73 | DHFR (0.66) | DHFRFGFR1SRCADORA2AADORA1 | |
| SCHEMBL30725521 | 0.73 | DHFR (0.47) | DHFRFGFR1KMT2A | |
| Hydrochloric Acid SCHEMBL12813248 | 0.72 | DHFR (0.64) | DHFRFGFR1SRCADORA2AADORA1 | |
| Hydrochloric Acid SCHEMBL1091696 | 0.72 | DHFR (0.64) | DHFRFGFR1SRCADORA2AADORA1 | |
| SCHEMBL4629601 | 0.70 | ADORA1 (0.63) | DHFRADORA2AADORA1KMT2A | |
| SCHEMBL736022 | 0.70 | DHFR (0.58) | DHFRFGFR1SRCADORA2AADORA1 | |
| SCHEMBL1388506 | 0.70 | DHFR (0.67) | DHFRKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023159307-A9 | POLO-LIKE KINASE 4 (PLK4) INHIBITORS, PHARMACEUTICAL COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF | REPARE THERAPEUTICS INC. (CA) | 2024-03-21 | — | — | WO | disclosed |
| WO-2023159307-A1 | POLO-LIKE KINASE 4 (PLK4) INHIBITORS, PHARMACEUTICAL COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF | REPARE THERAPEUTICS INC. (CA) | 2023-08-31 | — | — | WO | disclosed |