Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 10/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 10/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 9/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 9/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 9/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 9/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 9/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4846108 | 0.75 | ALDH1A1 (0.47) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL21409852 | 0.74 | CD44 (0.34) | LMNACD44KDM4EALDH1A1GAA | |
| SCHEMBL2758406 | 0.74 | EPHX2 (0.37) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL27829406 | 0.73 | SLC6A2 (0.41) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL13330416 | 0.73 | SIGMAR1 (0.42) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL13330451 | 0.72 | EED (0.33) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL22453128 | 0.71 | LMNA (0.56) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL27847914 | 0.71 | GRIN1 (0.40) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL27829443 | 0.71 | PNMT (0.37) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL28090104 | 0.70 | GRIN1 (0.49) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B |
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-104592034-B | A kind of synthetic method of 1,3-diamino-phenyl-5,7-dimethyladamantane | 中钢集团鞍山热能研究院有限公司 | 2016-07-20 | — | — | CN | disclosed |