Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28038209 | 0.84 | PTGS2 (0.47) | PTGS2TUBB1SMN1; SMN2NFE2L2MAPT | |
| SCHEMBL29642252 | 0.75 | ALDH1A1 (0.47) | PTGS2GABRA1SIGMAR1TSHRPTGS1 | |
| SCHEMBL336067 | 0.75 | ALDH1A1 (0.47) | PTGS2GABRA1SIGMAR1TSHRPTGS1 | |
| SCHEMBL7089415 | 0.75 | PTGS2 (0.56) | PTGS2PTGS1ALOX5TUBB1NFE2L2 | |
| SCHEMBL14686297 | 0.73 | PTGS2 (0.46) | PTGS2HTTLMNAPTGS1ALOX5 | |
| SCHEMBL9996728 | 0.71 | GABRA1 (0.44) | PTGS2GABRA1SIGMAR1PTGS1ALOX5 | |
| SCHEMBL13088831 | 0.71 | GABRA1 (0.44) | PTGS2GABRA1SIGMAR1PTGS1ALOX5 | |
| SCHEMBL7595327 | 0.71 | TP53 (0.45) | PTGS2GABRA1SIGMAR1TSHRHTT | |
| SCHEMBL16958944 | 0.71 | GABRA1 (0.47) | PTGS2GABRA1SIGMAR1PTGS1ALOX5 | |
| SCHEMBL14686323 | 0.71 | NFE2L2 (0.54) | PTGS2MAPK1PTGS1NFE2L2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108026094-B | Substituted 4-azaindoles and their use as modulators of the GLUN2B receptor | 詹森药业有限公司 | 2021-02-09 | — | — | CN | claimed |
| CN-108026094-B | Substituted 4-azaindoles and their use as modulators of the GLUN2B receptor | 詹森药业有限公司 | 2021-02-09 | — | — | CN | disclosed |