Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | ALPI | P09923 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.33 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL28944057 | 0.71 | ALDH1A1 (0.46) | LMNAALDH1A1MAPTSMN1; SMN2HTT | |
| SCHEMBL944379 | 0.71 | ALDH1A1 (0.50) | LMNAALDH1A1MAPTSMN1; SMN2POLB | |
| SCHEMBL31717936 | 0.71 | ALDH1A1 (0.50) | LMNAALDH1A1MAPTSMN1; SMN2POLB | |
| SCHEMBL4030686 | 0.69 | MAPT (0.54) | LMNAALDH1A1MAPTSMN1; SMN2POLB | |
| Ethylene SCHEMBL28813674 | 0.68 | LMNA (0.40) | LMNAALDH1A1MAPTSMN1; SMN2HTT | |
| SCHEMBL28056867 | 0.68 | KDM4E (0.36) | LMNAALDH1A1MAPTSMN1; SMN2HPGD | |
| Ammonia Solution, Strong SCHEMBL1640555 | 0.67 | ALDH1A1 (0.62) | LMNAALDH1A1MAPTPOLBHPGD | |
| SCHEMBL9568960 | 0.66 | LMNA (0.46) | LMNAALDH1A1MAPTHTTPOLB | |
| SCHEMBL351155 | 0.66 | CYP1A2 (0.50) | LMNAALDH1A1MAPTSMN1; SMN2POLB | |
| SCHEMBL112040 | 0.65 | — | — |
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-103992265-B | Two three bromo 1,3-bis-pyridine alkali propane and preparation method thereof, using method, recovery method and application | XI'AN JIAOTONG UNIVERSITY (CN) | 2016-02-24 | — | — | CN | disclosed |