Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRBN | Q96SW2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 6/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | NAMPT | P43490 | 2/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2574768 | 0.90 | MAPT (0.40) | CRBNMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2535710 | 0.89 | PTPN1 (0.49) | MEN1KMT2ASMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL2570852 | 0.88 | CRBN (0.39) | CRBNMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2534932 | 0.86 | RAB9A (0.55) | MEN1KMT2ASMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL2531931 | 0.85 | ALDH1A1 (0.42) | CRBNMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2529286 | 0.84 | ALDH1A1 (0.41) | CRBNMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2533556 | 0.83 | ALDH1A1 (0.41) | MEN1KMT2ASMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL2535566 | 0.83 | AURKB (0.45) | MEN1KMT2ASMN1; SMN2RAB9ANPC1 | |
| SCHEMBL2568952 | 0.83 | CRBN (0.39) | CRBNMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2531679 | 0.82 | ALDH1A1 (0.39) | MEN1KMT2ASMN1; SMN2ALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2558449-A1 | NOVEL 3,3-DIMETHYL TETRAHYDROQUINOLINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2013-02-20 | — | — | EP | disclosed |
| WO-2011128251-A1 | NOVEL 3,3-DIMETHYL TETRAHYDROQUINOLINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-10-20 | — | — | WO | disclosed |