Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.33 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.32 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL51449 | 0.96 | — | — | |
| SCHEMBL28181090 | 0.96 | ALDH1A1 (0.36) | ALDH1A1TSHRKDM4EMEN1LMNA | |
| Alcohol SCHEMBL791739 | 0.94 | ALDH1A1 (0.33) | ALDH1A1TSHRKDM4EMEN1LMNA | |
| SCHEMBL19305350 | 0.94 | ALDH1A1 (0.35) | ALDH1A1TSHRKDM4EMEN1LMNA | |
| Water SCHEMBL4304540 | 0.94 | ALDH1A1 (0.35) | ALDH1A1TSHRKDM4EMEN1LMNA | |
| Acetone SCHEMBL28094281 | 0.92 | PKM (0.33) | ALDH1A1TSHRKDM4EMEN1LMNA | |
| Methoxymethane SCHEMBL28228821 | 0.92 | ALDH1A1 (0.32) | ALDH1A1TSHRKDM4EMEN1LMNA | |
| Formic Acid SCHEMBL18555293 | 0.92 | ALDH1A1 (0.34) | ALDH1A1TSHRMAOB | |
| Water SCHEMBL28207794 | 0.92 | ALDH1A1 (0.34) | ALDH1A1TSHRMAOB | |
| Hydrochloric Acid SCHEMBL28152998 | 0.92 | ALDH1A1 (0.34) | ALDH1A1TSHRMAOB |
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-105032427-B | A kind of preparation method of 2,5 dimethyl furan | 华东理工大学 | 2018-04-06 | — | — | CN | claimed |
| CN-109794244-A | A kind of copper catalyst and its preparation method and application for 5 hydroxymethyl furfural selective hydrogenation | 广州大学 | 2019-05-24 | — | — | CN | disclosed |