Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL21231111 | 0.94 | SIGMAR1 (0.35) | GRIN2BSIGMAR1GRIN1IDO1 | |
| SCHEMBL20832374 | 0.92 | SIGMAR1 (0.32) | GRIN2BSIGMAR1 | |
| SCHEMBL20832372 | 0.91 | GRIN2B (0.42) | GRIN2BSIGMAR1GRIN1IDO1 | |
| SCHEMBL20832228 | 0.89 | GRIN2B (0.37) | GRIN2BSIGMAR1GRIN1CYP1A2CYP2C9 | |
| SCHEMBL20832102 | 0.87 | GRIN1 (0.33) | GRIN2BSIGMAR1GRIN1 | |
| SCHEMBL20832512 | 0.82 | GRIN2B (0.36) | GRIN2BGRIN1 | |
| SCHEMBL20832376 | 0.81 | GRIN2B (0.42) | GRIN2BSIGMAR1GRIN1CYP1A2CYP2C9 | |
| SCHEMBL20832135 | 0.79 | GRIN2B (0.38) | GRIN2BGRIN1CYP1A2 | |
| SCHEMBL26891217 | 0.77 | IDO1 (0.36) | GRIN2BSIGMAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL20617241 | 0.77 | GRIN2B (0.44) | GRIN2BGRIN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2371016-B1 | ORGANIC LIGHT EMITTING EVICES COMPRISING TRIAZINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2019-08-07 | — | — | EP | disclosed |