Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Tetrahydrofuran SCHEMBL28312832 | 0.97 | ALDH1A1 (0.44) | ALDH1A1CRBNKDM4ETSHRNFKB1 | |
| Tetrahydrofuran SCHEMBL11243708 | 0.92 | ALDH1A1 (0.40) | ALDH1A1CRBNKDM4ETSHRNFKB1 | |
| Tetrahydrofuran SCHEMBL27547612 | 0.80 | — | — | |
| Tetrahydrofuran SCHEMBL27694683 | 0.79 | ALDH1A1 (0.42) | ALDH1A1CRBNKDM4ETSHRNFKB1 | |
| Tetrahydrofuran SCHEMBL10621146 | 0.77 | ALDH1A1 (0.53) | ALDH1A1KDM4ETSHRLMNACA9 | |
| Tetrahydrofuran SCHEMBL27541147 | 0.77 | — | — | |
| Cyclohexane SCHEMBL1882975 | 0.76 | CRBN (0.50) | ALDH1A1CRBNTSHRNFKB1LMNA | |
| Cyclopentane SCHEMBL22729196 | 0.76 | CRBN (0.50) | ALDH1A1CRBNTSHRNFKB1LMNA | |
| SCHEMBL11354262 | 0.76 | CRBN (0.50) | ALDH1A1CRBNTSHRNFKB1LMNA | |
| Methane SCHEMBL28134179 | 0.76 | CRBN (0.56) | ALDH1A1CRBNTSHRNFKB1LMNA |
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-109576811-A | A kind of modified synthetic fibers composition | 福建省银河服饰有限公司 | 2019-04-05 | — | — | CN | claimed |