Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 13/20 | 0.56 |
| ▸ | TP53 | P04637 | 5/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 3/20 | 0.54 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.54 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 6/20 | 0.46 |
| ▸ | RAB9A | P51151 | 6/20 | 0.46 |
| ▸ | LIMK1 | P53667 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.44 |
| ▸ | RELA | Q04206 | 2/20 | 0.44 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19805090 | 0.86 | NPC1 (0.61) | MAPTTP53THRBPOLBROCK2 | |
| SCHEMBL18537683 | 0.82 | LIMK1 (0.67) | MAPTTP53THRBPOLBNPC1 | |
| SCHEMBL23009514 | 0.78 | KDM4E (0.58) | MAPTTP53THRBPOLBROCK2 | |
| SCHEMBL20731005 | 0.74 | ALDH1A1 (0.62) | MAPTTP53NPC1RAB9ALIMK1 | |
| SCHEMBL24729646 | 0.74 | ALDH1A1 (0.45) | MAPTTP53POLBNPC1RAB9A | |
| SCHEMBL21051652 | 0.72 | MAP2K3 (0.45) | MAPTTP53THRBPOLBROCK2 | |
| SCHEMBL19737752 | 0.72 | MAPT (0.85) | MAPTTP53THRBPOLBROCK2 | |
| SCHEMBL23938107 | 0.71 | KDM4E (0.42) | MAPTTP53THRBPOLBTDP1 | |
| SCHEMBL8143280 | 0.69 | PIK3CD (0.53) | MAPTTP53THRBPOLBROCK2 | |
| SCHEMBL23937997 | 0.69 | KDM4E (0.41) | MAPTTHRBPOLBTDP1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017217439-A1 | THIENO[2,3-b]PYRIDINE DERIVATIVE AND QUINOLINE DERIVATIVE, AND USE THEREOF | 国立大学法人東京大学 | 2017-12-21 | — | — | WO | disclosed |