Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | FBP1 | P09467 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 6/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 6/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 6/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.30 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30640171 | 0.79 | NPC1 (0.38) | RXRAGRIN1GRIN2BNPC1RAB9A | |
| SCHEMBL22732065 | 0.74 | MBOAT4 (0.34) | RXRAGRIN1GRIN2BPOLBCYP1A2 | |
| SCHEMBL22717514 | 0.74 | MEN1 (0.41) | HTTFBP1POLBNPC1RAB9A | |
| SCHEMBL22527882 | 0.73 | NPC1 (0.38) | RXRAGRIN1GRIN2BNPC1RAB9A | |
| SCHEMBL11926655 | 0.70 | GRM2 (0.37) | RXRAGRIN1GRIN2BNPC1RAB9A | |
| SCHEMBL12141412 | 0.69 | S1PR4 (0.47) | NPC1RAB9AALOX5APFEN1GRM2 | |
| SCHEMBL4379496 | 0.69 | IDO1 (0.48) | ALOX5APFEN1GRM2GRM3MBOAT4 | |
| SCHEMBL26028010 | 0.69 | GRM2 (0.36) | RXRAGRIN1GRIN2BNPC1RAB9A | |
| SCHEMBL94427 | 0.67 | SMN1; SMN2 (0.50) | HTTNPC1RAB9ACYP1A2CYP2C9 | |
| SCHEMBL1711781 | 0.66 | CYP1A2 (0.40) | NPC1RAB9ACYP1A2CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020243459-A1 | THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2020-12-03 | — | — | WO | disclosed |