Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 4/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | RET | P07949 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | LTK | P29376 | 1/20 | 0.36 |
| ▸ | GRK5 | P34947 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | CLK2 | P49760 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30452418 | 0.81 | NOS2 (0.40) | NOS3NOS2SIGMAR1 | |
| SCHEMBL4130355 | 0.72 | NOS3 (0.46) | NOS3NOS2SIGMAR1 | |
| SCHEMBL27961588 | 0.72 | NOS3 (0.46) | NOS3NOS2SIGMAR1 | |
| SCHEMBL30429738 | 0.69 | TRPA1 (0.34) | NOS3NOS2 | |
| SCHEMBL28334509 | 0.69 | NOS3 (0.52) | GRIN2BNOS3NOS2SLC18A3 | |
| SCHEMBL41763 | 0.67 | — | — | |
| SCHEMBL190417 | 0.67 | SLC18A3 (0.67) | GRIN2BSLC18A3SIGMAR1 | |
| Benzene SCHEMBL23070411 | 0.65 | SLC18A3 (0.64) | GRIN2BSLC18A3SIGMAR1 | |
| Hydrogen Peroxide SCHEMBL2353767 | 0.65 | SLC18A3 (0.64) | GRIN2BSLC18A3SIGMAR1 | |
| Hydrochloric Acid SCHEMBL29241797 | 0.65 | SLC18A3 (0.64) | GRIN2BSLC18A3SIGMAR1 |
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-110563631-B | IDO inhibiting compound and application thereof | 爱斯特（成都）生物制药股份有限公司 | 2023-05-23 | — | — | CN | disclosed |