Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.35 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | POLB | P06746 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.32 |
| ▸ | MEN1 | O00255 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.31 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL27888674 | 0.89 | LMNA (0.40) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL28800748 | 0.87 | GAA (0.36) | ALDH1A1MAPTKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL2534324 | 0.84 | WDR5 (0.40) | ITGB1ITGA5ALDH1A1HIF1AMAPT | |
| SCHEMBL27888442 | 0.83 | KMT2A (0.39) | ALDH1A1HIF1AMAPTPOLBKMT2A | |
| SCHEMBL27905169 | 0.83 | NR1H4 (0.32) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL27888373 | 0.81 | ITGB1 (0.35) | ITGB1ITGA5ALDH1A1HIF1AMAPT | |
| SCHEMBL19071956 | 0.75 | ALDH1A1 (0.50) | ITGB1ITGA5ALDH1A1HIF1AMAPT | |
| SCHEMBL2530595 | 0.72 | LMNA (0.46) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL27888375 | 0.69 | MAPT (0.41) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL27357985 | 0.67 | ATM (0.51) | ITGB1ITGA5ALDH1A1MAPTPOLB |
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-102858746-A | Novel 3,3-dimethyl tetrahydroquinoline derivatives | HOFFMANN LA ROCHE | 2013-01-02 | — | — | CN | disclosed |