Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.36 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28197607 | 0.90 | LMNA (0.52) | KMT2ATDP1LMNAMEN1THRB | |
| SCHEMBL711033 | 0.88 | LMNA (0.55) | KMT2ATDP1LMNAMEN1THRB | |
| Biphenyl SCHEMBL4457432 | 0.85 | LMNA (0.46) | KMT2ATDP1LMNAMEN1THRB | |
| SCHEMBL3045043 | 0.82 | LMNA (0.48) | KMT2ATDP1LMNAMEN1THRB | |
| Toluene SCHEMBL28029835 | 0.81 | ALDH1A1 (0.45) | KMT2ATDP1LMNAMEN1THRB | |
| Pyridine SCHEMBL1221198 | 0.80 | KMT2A (0.41) | KMT2ATDP1LMNAMEN1THRB | |
| SCHEMBL3735222 | 0.78 | MEN1 (0.43) | KMT2ATDP1LMNAMEN1THRB | |
| Thiophene SCHEMBL28196895 | 0.78 | LMNA (0.43) | KMT2ATDP1LMNAMEN1THRB | |
| SCHEMBL9842365 | 0.77 | TDP1 (0.41) | KMT2ATDP1LMNAMEN1THRB | |
| SCHEMBL4453445 | 0.74 | MEN1 (0.39) | KMT2ATDP1LMNAMEN1THRB |
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-107641068-A | A kind of preparation method of indone analog derivative | 浙江工业大学 | 2018-01-30 | — | — | CN | disclosed |