Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | PRKCA | P17252 | 1/20 | 0.34 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.34 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.34 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7719953 | 0.86 | MEN1 (0.38) | MAPTMAPK1MEN1KMT2A | |
| SCHEMBL15519768 | 0.83 | ALDH1A1 (0.48) | MAPTMAPK1LMNAALDH1A1PRKCA | |
| SCHEMBL7723645 | 0.78 | AR (0.35) | MAPTLMNACYP1A2TSHRMEN1 | |
| SCHEMBL7716828 | 0.78 | AR (0.35) | MAPTLMNACYP1A2TSHRMEN1 | |
| SCHEMBL7719955 | 0.78 | AR (0.35) | MAPTLMNACYP1A2TSHRMEN1 | |
| SCHEMBL15120983 | 0.75 | ALDH1A1 (0.59) | MAPTMAPK1LMNAALDH1A1PRKCA | |
| SCHEMBL27830247 | 0.72 | ALDH1A1 (0.40) | MAPTMAPK1LMNAALDH1A1PRKCA | |
| SCHEMBL4643109 | 0.72 | TSHR (0.35) | ALDH1A1TSHR | |
| SCHEMBL8744238 | 0.71 | ALDH1A1 (0.36) | MAPTMAPK1LMNAALDH1A1TSHR | |
| SCHEMBL10476475 | 0.71 | MAPK1 (0.41) | MAPTMAPK1LMNAALDH1A1PRKCA |
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 |
|---|---|---|---|---|---|---|---|
| JP-3153655-A | — | — | None | — | — | JP | disclosed |
| JP-H03153655-A | 4-HALO-3-ACYLOXYBUTANE NITRILE AND PREPARATION THEREOF | KANEGAFUCHI CHEM IND CO LTD | 1991-07-01 | — | — | JP | disclosed |