Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | G6PD | P11413 | 1/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PDE4A | P27815 | 2/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28892621 | 1.00 | NSD2 (0.41) | NSD2CASP6G6PDPDGFRBPDGFRA | |
| SCHEMBL30003250 | 0.87 | NSD2 (0.41) | NSD2CASP6G6PDPDGFRBPDGFRA | |
| SCHEMBL28892537 | 0.87 | NSD2 (0.41) | NSD2CASP6G6PDPDGFRBPDGFRA | |
| SCHEMBL28892170 | 0.82 | KIT (0.36) | NSD2CASP6G6PDSMN1; SMN2KIT | |
| SCHEMBL30002605 | 0.82 | KIT (0.36) | NSD2CASP6G6PDSMN1; SMN2KIT | |
| SCHEMBL30002047 | 0.82 | ALDH1A1 (0.43) | CASP6MEN1KMT2ANPC1RAB9A | |
| SCHEMBL28892922 | 0.82 | ALDH1A1 (0.43) | CASP6MEN1KMT2ANPC1RAB9A | |
| SCHEMBL30002712 | 0.81 | NSD2 (0.47) | NSD2CASP6G6PDPDGFRBPDGFRA | |
| SCHEMBL28959473 | 0.81 | NSD2 (0.47) | NSD2CASP6G6PDPDGFRBPDGFRA | |
| SCHEMBL28892522 | 0.79 | MAOA (0.40) | MEN1KMT2ACYP1A2MAOAKDM4E |
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-115232144-B | Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-115232144-A | Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-10-25 | — | — | CN | disclosed |