Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | WRN | Q14191 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL23049572 | 0.80 | LMNA (0.33) | ALDH1A1TSHRTDP1LMNAHSD17B10 | |
| SCHEMBL136377 | 0.78 | NAAA (0.45) | ALDH1A1TSHRTDP1NAAACYP1A2 | |
| SCHEMBL14472846 | 0.78 | NAAA (0.43) | ALDH1A1TDP1NAAACYP1A2HPGD | |
| SCHEMBL15281013 | 0.78 | LMNA (0.45) | ALDH1A1TSHRTDP1NAAACYP1A2 | |
| SCHEMBL25383365 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TSHRTDP1LMNAHSD17B10 | |
| SCHEMBL722286 | 0.78 | NAAA (0.43) | ALDH1A1TDP1NAAACYP1A2HPGD | |
| SCHEMBL19906343 | 0.77 | TET2 (0.32) | ALDH1A1TSHRTDP1GAA | |
| SCHEMBL25383367 | 0.76 | ALDH1A1 (0.38) | ALDH1A1TSHRTDP1LMNAHSD17B10 | |
| Hydrochloric Acid SCHEMBL29626584 | 0.76 | NAAA (0.41) | ALDH1A1TDP1NAAACYP1A2HPGD | |
| SCHEMBL4450857 | 0.76 | NAAA (0.41) | ALDH1A1TDP1NAAACYP1A2HPGD |
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-105037155-A | Batch distillation process for separating tert-butyl alcohol-methyl propionate azeotrope by mixed extractant | UNIV JINAN | 2015-11-11 | — | — | CN | disclosed |