Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MYOC | Q99972 | 1/20 | 0.36 |
| ▸ | BCL9 | O00512 | 1/20 | 0.35 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL27905188 | 0.87 | ITGB1 (0.35) | GAAALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL27888674 | 0.87 | LMNA (0.40) | GAAALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL27905169 | 0.87 | NR1H4 (0.32) | GAAALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL27888442 | 0.83 | KMT2A (0.39) | GAAALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL2536265 | 0.81 | MEN1 (0.46) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL2537858 | 0.70 | ALDH1A1 (0.41) | GAAALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL2529404 | 0.70 | CACNA1C (0.54) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| 4-Nitrophenyl Acetate SCHEMBL74985 | 0.70 | GAA (0.66) | GAAALDH1A1KMT2AMAPTMAPK1 | |
| 4-Nitrophenyl Acetate SCHEMBL8769916 | 0.69 | GAA (0.64) | GAAALDH1A1KMT2AMAPTMAPK1 | |
| 4-Nitrophenyl Acetate SCHEMBL21824458 | 0.69 | GAA (0.64) | GAAALDH1A1KMT2AMAPTMAPK1 |
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-102858746-B | Novel 3,3-dimethyl tetrahydroquinoline derivatives | HOFFMANN LA ROCHE | 2014-07-16 | — | — | CN | disclosed |
| CN-102858746-A | Novel 3,3-dimethyl tetrahydroquinoline derivatives | HOFFMANN LA ROCHE | 2013-01-02 | — | — | CN | disclosed |