Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Piperidine SCHEMBL4124279 | 0.98 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10TSHROPRM1 | |
| Piperidine SCHEMBL27915255 | 0.96 | ALDH1A1 (0.58) | ALDH1A1LMNAHSD17B10TSHROPRM1 | |
| Ethyl Acetate SCHEMBL28024376 | 0.93 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10TSHROPRM1 | |
| Piperazine SCHEMBL6093828 | 0.91 | ALDH1A1 (0.70) | ALDH1A1LMNAHSD17B10TSHROPRM1 | |
| Piperazine SCHEMBL27792846 | 0.88 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TSHROPRM1 | |
| Piperazine SCHEMBL28654365 | 0.86 | ALDH1A1 (0.64) | ALDH1A1LMNAHSD17B10TSHROPRM1 | |
| Ethyl Acetate SCHEMBL27354887 | 0.84 | ALDH1A1 (0.54) | ALDH1A1LMNAHSD17B10TSHROPRM1 | |
| Cyclohexane SCHEMBL5908851 | 0.83 | ALDH1A1 (0.82) | ALDH1A1LMNAHSD17B10TSHRALOX15 | |
| Cyclohexane SCHEMBL232777 | 0.83 | ALDH1A1 (0.82) | ALDH1A1LMNAHSD17B10TSHRALOX15 | |
| Cyclohexane SCHEMBL510060 | 0.83 | ALDH1A1 (0.82) | ALDH1A1LMNAHSD17B10TSHRALOX15 |
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-106591179-B | Methyl packing bacterium and its prepare the application on (S)-α-ethyl -2- oxygen -1- pyrrolidine acetic acid salt in selective fractionation | 长兴制药股份有限公司 | 2018-07-03 | — | — | CN | disclosed |