Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.65 |
| ▸ | ACHE | P22303 | 3/20 | 0.65 |
| ▸ | TSHR | P16473 | 2/20 | 0.65 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.65 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.50 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.50 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 2/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ACP3 | P15309 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Toluene SCHEMBL9481660 | 0.84 | ACHE (0.92) | LMNAACHETSHRALOX12CES2 | |
| Toluene SCHEMBL9622812 | 0.84 | — | — | |
| Toluene SCHEMBL9303536 | 0.84 | — | — | |
| Toluene SCHEMBL27883778 | 0.84 | ACHE (0.92) | LMNAACHETSHRALOX12CES2 | |
| Toluene SCHEMBL48134 | 0.81 | LMNA (0.73) | LMNAACHETSHRALOX12CES2 | |
| Toluene SCHEMBL6889473 | 0.81 | ACHE (0.73) | LMNAACHETSHRALOX12CES2 | |
| Toluene SCHEMBL7355317 | 0.81 | LMNA (0.73) | LMNAACHETSHRALOX12CES2 | |
| Toluene SCHEMBL27369787 | 0.81 | LMNA (0.73) | LMNAACHETSHRALOX12CES2 | |
| Toluene SCHEMBL2914390 | 0.81 | LMNA (0.73) | LMNAACHETSHRALOX12CES2 | |
| Toluene SCHEMBL7662176 | 0.81 | — | — |
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-105384658-A | Method for synthesizing anisonitrile | UNIV YANGZHOU | 2016-03-09 | — | — | CN | disclosed |