Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | STAT1 | P42224 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8586891 | 0.84 | ALDH1A1 (0.45) | ALDH1A1TSHRHTTL3MBTL1GAA | |
| SCHEMBL669513 | 0.84 | — | — | |
| Aes-103 SCHEMBL9256544 | 0.84 | ALDH1A1 (0.71) | ALDH1A1TSHRHTTL3MBTL1GAA | |
| Acetonitrile SCHEMBL28721540 | 0.78 | ALDH1A1 (0.52) | ALDH1A1TSHRHTTL3MBTL1GAA | |
| SCHEMBL6571061 | 0.75 | POLB (0.40) | ALDH1A1TSHRHTTL3MBTL1GAA | |
| SCHEMBL29219910 | 0.74 | ALDH1A1 (0.47) | ALDH1A1TSHRHTTL3MBTL1GAA | |
| Furfural SCHEMBL29233534 | 0.72 | ALDH1A1 (0.60) | ALDH1A1TSHRHTTL3MBTL1GAA | |
| SCHEMBL721921 | 0.72 | ALDH1A1 (0.57) | ALDH1A1TSHRHTTL3MBTL1GAA | |
| SCHEMBL16564347 | 0.72 | ALDH1A1 (0.57) | ALDH1A1TSHRHTTL3MBTL1GAA | |
| SCHEMBL3058101 | 0.71 | ALDH1A1 (0.52) | ALDH1A1TSHRHTTL3MBTL1GAA |
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-10130251-A | — | — | None | — | — | JP | disclosed |
| JP-H10130251-A | PURIFICATION OF 2-FURALDEHYDE ACETAL DERIVATIVE | SUMITOMO CHEM CO LTD | 1998-05-19 | — | — | JP | disclosed |