Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | GAA | P10253 | 5/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SNCA | P37840 | 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 | |
|---|---|---|---|---|
| SCHEMBL7938078 | 0.86 | TRPA1 (0.54) | MAPTGAATDP1KDM4EMEN1 | |
| SCHEMBL5374279 | 0.83 | TDP1 (0.39) | MAPTGAATDP1KDM4EMEN1 | |
| SCHEMBL9118423 | 0.82 | MAPT (0.56) | MAPTGAATDP1KDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL9121083 | 0.80 | MAPT (0.54) | MAPTGAATDP1KDM4EMEN1 | |
| SCHEMBL22169138 | 0.79 | CXCR2 (0.50) | MAPTGAATDP1KDM4EMEN1 | |
| SCHEMBL4946590 | 0.78 | GAA (0.50) | MAPTGAATDP1KDM4EMEN1 | |
| SCHEMBL13652999 | 0.78 | ALDH1A1 (0.59) | MAPTGAATDP1KDM4EMEN1 | |
| SCHEMBL5242624 | 0.78 | CYP3A4 (0.62) | MAPTGAATDP1KDM4EMEN1 | |
| SCHEMBL3228186 | 0.77 | MAPT (0.52) | MAPTGAATDP1KDM4EMEN1 | |
| SCHEMBL2677107 | 0.77 | MAPT (0.71) | MAPTGAATDP1KDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105503747-A | Novel quinazoline derivative LU1507 as well as preparation method and application thereof | NANJING GENERAL HOSPITAL NANJING MILITARY AREA COMMAND PLA | 2016-04-20 | — | — | CN | disclosed |
| CN-105481835-A | Novel quinazoline derivative LU1508, and preparation method and application thereof | NANJING GENERAL HOSPITAL NANJING MILITARY AREA COMMAND PLA | 2016-04-13 | — | — | CN | disclosed |