Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.37 |
| ▸ | SELE | P16581 | 1/20 | 0.37 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20510894 | 1.00 | KDM4E (0.40) | KDM4EALDH1A1SMN1; SMN2ICAM1SELE | |
| SCHEMBL30360759 | 0.83 | TSHR (0.35) | KDM4EALDH1A1SMN1; SMN2ADRA2CADRA2A | |
| SCHEMBL20511171 | 0.83 | TSHR (0.35) | KDM4EALDH1A1SMN1; SMN2ADRA2CADRA2A | |
| SCHEMBL8655295 | 0.81 | GABRA1 (0.43) | KDM4EALDH1A1SMN1; SMN2GABRA1GABRB2 | |
| SCHEMBL31185609 | 0.81 | GABRA1 (0.43) | KDM4EALDH1A1SMN1; SMN2GABRA1GABRB2 | |
| Water SCHEMBL8939878 | 0.81 | ALDH1A1 (0.49) | KDM4EALDH1A1ICAM1SELEVCAM1 | |
| SCHEMBL8626899 | 0.79 | SMN1; SMN2 (0.50) | KDM4EALDH1A1SMN1; SMN2LMNATSHR | |
| SCHEMBL9123978 | 0.79 | SMN1; SMN2 (0.49) | KDM4EALDH1A1SMN1; SMN2LMNATSHR | |
| SCHEMBL29387985 | 0.79 | SMN1; SMN2 (0.49) | KDM4EALDH1A1SMN1; SMN2LMNATSHR | |
| SCHEMBL88415 | 0.79 | ALDH1A1 (0.50) | KDM4EALDH1A1ICAM1SELEVCAM1 |
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-110461814-B | Resin blends, prepregs and articles containing a phthalonitrile reactive diluent and a bisphthalonitrile resin | 3M创新有限公司 | 2023-04-14 | — | — | CN | disclosed |