Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8380728 | 1.00 | ALDH1A1 (0.47) | ALDH1A1KDM4EGAAHPGDMEN1 | |
| SCHEMBL28126890 | 0.85 | KMT2A (0.53) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL14811753 | 0.84 | MEN1 (0.64) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL8182437 | 0.84 | MEN1 (0.64) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL1444837 | 0.83 | ALDH1A1 (0.42) | ALDH1A1KDM4EGAAHPGDLMNA | |
| SCHEMBL11800607 | 0.82 | LMNA (0.50) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL430650 | 0.82 | NR1H4 (0.50) | KDM4ECYP1A2TSHRNR1H4 | |
| SCHEMBL77601 | 0.82 | MAPT (0.53) | ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL11802948 | 0.81 | THRB (0.54) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL8332854 | 0.80 | NR1H4 (0.62) | ALDH1A1KDM4EHPGDMEN1KMT2A |
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-11255713-A | — | — | None | — | — | JP | disclosed |
| JP-H11255713-A | BENZALMALONATE DERIVATIVE | KAO CORP | 1999-09-21 | — | — | JP | disclosed |