Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14458046 | 0.76 | ALDH1A1 (0.34) | ALDH1A1KDM4ETDP1TSHRLMNA | |
| SCHEMBL19649525 | 0.76 | ALDH1A1 (0.34) | ALDH1A1KDM4ETDP1TSHRLMNA | |
| SCHEMBL11222810 | 0.74 | NR3C1 (0.31) | — | |
| SCHEMBL6557553 | 0.71 | ALDH1A1 (0.33) | ALDH1A1KDM4ETSHRLMNAGAA | |
| SCHEMBL5606210 | 0.71 | ALDH1A1 (0.33) | ALDH1A1KDM4ETSHRLMNAGAA | |
| SCHEMBL14458137 | 0.71 | ALDH1A1 (0.33) | ALDH1A1KDM4ETSHRLMNAGAA | |
| SCHEMBL11177204 | 0.71 | CCNA2 (0.34) | ALDH1A1TSHRMAPT | |
| SCHEMBL1713453 | 0.67 | ALDH1A1 (0.33) | ALDH1A1KDM4ETSHRLMNAGAA | |
| SCHEMBL28129125 | 0.67 | MEN1 (0.40) | ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL9348083 | 0.66 | L3MBTL1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-57048955-A | — | — | None | — | — | JP | disclosed |
| JP-S5748955-A | DIMERIZATION OF 3-METHYL-BUTENENITRILE | SHIZUOKA DAIGAKU | 1982-03-20 | — | — | JP | disclosed |