Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | FHIT | P49789 | 1/20 | 0.33 |
| ▸ | GRM6 | O15303 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MPI | P34949 | 1/20 | 0.32 |
| ▸ | IGF1R | P08069 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9446743 | 0.88 | GRM6 (0.33) | ALDH1A1HPGDCYP1A2GRM6 | |
| SCHEMBL27363484 | 0.88 | GRM6 (0.33) | ALDH1A1HPGDCYP1A2GRM6 | |
| SCHEMBL27703537 | 0.83 | ALDH1A1 (0.49) | ALDH1A1HPGDCYP1A2MAPTGAA | |
| SCHEMBL4686476 | 0.75 | GRM6 (0.40) | ALDH1A1HPGDCYP1A2MAPTGAA | |
| SCHEMBL27754067 | 0.74 | GRM6 (0.36) | ALDH1A1HPGDGRM6 | |
| SCHEMBL11262436 | 0.73 | SMN1; SMN2 (0.41) | ALDH1A1HPGDCYP1A2MAPTGAA | |
| SCHEMBL27340438 | 0.72 | GRM6 (0.38) | ALDH1A1HPGDADORA1GRM6 | |
| SCHEMBL11264320 | 0.72 | ALDH1A1 (0.38) | ALDH1A1HPGDCYP1A2MAPTGAA | |
| SCHEMBL27638360 | 0.72 | GRM6 (0.41) | ALDH1A1HPGDCYP1A2MAPTGAA | |
| SCHEMBL27788513 | 0.70 | LMNA (0.56) | ALDH1A1HPGDCYP1A2MAPTGAA |
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-104744399-A | Preparation method of BTPA | ZHEJIANG HUAFANG PHARMACEUTICAL CO LTD | 2015-07-01 | — | — | CN | disclosed |