Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | ABL1 | P00519 | 2/20 | 0.52 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.52 |
| ▸ | BCR | P11274 | 2/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.50 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.50 |
| ▸ | MMP3 | P08254 | 2/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.45 |
| ▸ | ABAT | P80404 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28108647 | 0.83 | — | — | |
| SCHEMBL28199055 | 0.82 | ESR1 (0.67) | ESR1MEN1KMT2AABL1ABCB1 | |
| SCHEMBL13074463 | 0.78 | ESR1 (0.74) | ESR1MEN1KMT2AABL1ABCB1 | |
| SCHEMBL27704396 | 0.78 | ESR1 (0.60) | ESR1MEN1KMT2AABL1ABCB1 | |
| SCHEMBL27927635 | 0.77 | ESR1 (0.58) | ESR1MEN1KMT2AABL1ABCB1 | |
| SCHEMBL699012 | 0.76 | ESR1 (1.00) | ESR1MEN1KMT2AABL1ABCB1 | |
| SCHEMBL27269728 | 0.75 | ESR1 (0.56) | ESR1MEN1KMT2AABL1ABCB1 | |
| SCHEMBL28581912 | 0.74 | MMP3 (0.74) | ESR1MEN1KMT2AABL1ABCB1 | |
| SCHEMBL19730255 | 0.74 | ESR1 (0.65) | ESR1MEN1KMT2AABL1ABCB1 | |
| SCHEMBL27704402 | 0.74 | ESR1 (0.54) | ESR1MEN1KMT2AABL1ABCB1 |
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-104755422-B | Method for producing cyanogen halide, cyanate ester compound and method for producing same, and resin composition | 三菱瓦斯化学株式会社 | 2016-11-09 | — | — | CN | disclosed |