Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.55 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.50 |
| ▸ | TUBB | P07437 | 1/20 | 0.50 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.50 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.50 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.50 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28040566 | 0.87 | GAA (0.60) | KMT2AMEN1CYP3A4TDP1L3MBTL1 | |
| SCHEMBL2819604 | 0.83 | KMT2A (0.67) | KMT2AMEN1CYP3A4TDP1L3MBTL1 | |
| SCHEMBL28044188 | 0.82 | KDM4E (0.62) | KMT2AMEN1CYP3A4TDP1L3MBTL1 | |
| SCHEMBL28040073 | 0.82 | KMT2A (0.57) | KMT2AMEN1L3MBTL1ALDH1A1HPGD | |
| SCHEMBL23639738 | 0.81 | KMT2A (0.72) | KMT2AMEN1CYP3A4TDP1L3MBTL1 | |
| SCHEMBL31321630 | 0.81 | KMT2A (0.72) | KMT2AMEN1CYP3A4TDP1L3MBTL1 | |
| SCHEMBL28040066 | 0.81 | ALDH1A1 (0.52) | KMT2AMEN1CYP3A4L3MBTL1ALDH1A1 | |
| SCHEMBL17951283 | 0.81 | KMT2A (0.64) | KMT2AMEN1CYP3A4TDP1L3MBTL1 | |
| SCHEMBL16610045 | 0.80 | KMT2A (0.71) | KMT2AMEN1CYP3A4TDP1L3MBTL1 | |
| SCHEMBL22406315 | 0.80 | KMT2A (0.63) | KMT2AMEN1CYP3A4TDP1L3MBTL1 |
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-105175262-A | Chrysotoxine bibenzyl derivative and preparation method and application thereof | UNIV CHINA PHARMA | 2015-12-23 | — | — | CN | claimed |
| CN-105175262-A | Chrysotoxine bibenzyl derivative and preparation method and application thereof | UNIV CHINA PHARMA | 2015-12-23 | — | — | CN | disclosed |