Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | GAA | P10253 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | GLA | P06280 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27961875 | 0.85 | TLR8 (0.55) | ALDH1A1KDM4EGAAHPGDKMT2A | |
| SCHEMBL29034513 | 0.82 | ALDH1A1 (0.46) | ALDH1A1KDM4EGAAHPGDKMT2A | |
| SCHEMBL29562242 | 0.80 | ALDH1A1 (0.55) | ALDH1A1KDM4EGAAHPGDKMT2A | |
| SCHEMBL28201815 | 0.80 | ALDH1A1 (0.55) | ALDH1A1KDM4EGAAHPGDKMT2A | |
| SCHEMBL5387138 | 0.78 | ALDH1A1 (0.52) | ALDH1A1KDM4EGAAHPGDKMT2A | |
| SCHEMBL6652651 | 0.76 | KDM1A (0.50) | KDM4EKMT2APOLBMAPTL3MBTL1 | |
| SCHEMBL11058494 | 0.75 | ALDH1A1 (0.49) | ALDH1A1KDM4EGAAHPGDKMT2A | |
| SCHEMBL8418578 | 0.74 | TLR8 (0.50) | ALDH1A1KDM4EGAAHPGDKMT2A | |
| SCHEMBL8003433 | 0.74 | ALDH1A1 (0.45) | ALDH1A1KDM4EGAAHPGDKMT2A | |
| SCHEMBL4299906 | 0.74 | ALDH1A1 (0.70) | ALDH1A1KDM4EGAAHPGDKMT2A |
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-103896918-A | Compound as well as preparation method and application thereof | UNIV TSINGHUA GRADUATE SCHOOL | 2014-07-02 | — | — | CN | disclosed |