Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 3/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.49 |
| ▸ | FNTA | P49354 | 1/20 | 0.46 |
| ▸ | FNTB | P49356 | 1/20 | 0.46 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20510954 | 1.00 | ALDH1A1 (0.57) | ALDH1A1HPGDCYP19A1NPSR1MAOB | |
| SCHEMBL9471811 | 0.92 | CYP19A1 (0.56) | ALDH1A1HPGDCYP19A1NPSR1MAOB | |
| SCHEMBL29390509 | 0.86 | CYP19A1 (0.65) | ALDH1A1HPGDCYP19A1NPSR1MAOB | |
| SCHEMBL4581525 | 0.86 | CYP19A1 (0.65) | ALDH1A1HPGDCYP19A1NPSR1MAOB | |
| SCHEMBL8632247 | 0.85 | ALDH1A1 (0.54) | ALDH1A1HPGDCYP19A1NPSR1MAOB | |
| SCHEMBL523446 | 0.85 | ALDH1A1 (0.65) | ALDH1A1HPGDCYP19A1NPSR1MAOB | |
| SCHEMBL9745473 | 0.85 | ALDH1A1 (0.65) | ALDH1A1HPGDCYP19A1NPSR1MAOB | |
| SCHEMBL9747026 | 0.85 | ALDH1A1 (0.65) | ALDH1A1HPGDCYP19A1NPSR1MAOB | |
| SCHEMBL28288026 | 0.84 | GAA (0.53) | ALDH1A1HPGDCYP19A1NPSR1MAOB | |
| SCHEMBL1377229 | 0.84 | CYP19A1 (0.62) | ALDH1A1HPGDCYP19A1NPSR1MAOB |
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 |