Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.44 |
| ▸ | GBA1 | P04062 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4043115 | 0.82 | GRIN2B (0.57) | CA1CA2MTNR1AMTNR1BGRIN2B | |
| Hydrochloric Acid SCHEMBL4053518 | 0.80 | GRIN2B (0.56) | CA1CA2MTNR1AMTNR1BGRIN2B | |
| SCHEMBL10399460 | 0.80 | MTNR1A (0.51) | CA1CA2MTNR1AMTNR1BGRIN2B | |
| SCHEMBL29033596 | 0.79 | GRIN2B (0.54) | CA1CA2MTNR1AMTNR1BGRIN2B | |
| SCHEMBL30479468 | 0.79 | GRIN2B (0.54) | CA1CA2MTNR1AMTNR1BGRIN2B | |
| SCHEMBL24427605 | 0.74 | GRM5 (0.46) | CA1CA2MTNR1AMTNR1BGRIN2B | |
| SCHEMBL13573565 | 0.73 | GRIN2B (0.77) | CA1CA2GRIN2BMAOAMAOB | |
| SCHEMBL10399768 | 0.71 | TAOK1 (0.55) | GRIN2BSIGMAR1 | |
| SCHEMBL28127425 | 0.70 | POLB (0.47) | — | |
| SCHEMBL2980045 | 0.68 | GRIN2B (0.47) | CA1CA2GRIN2BGBA1SIGMAR1 |
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-107698622-B | Organic electronic device comprising a layer containing at least one metal-organic compound and at least one metal oxide | UDC 爱尔兰有限责任公司 | 2021-06-29 | — | — | CN | disclosed |