Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 6/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8114364 | 0.86 | ALDH1A1 (0.52) | ALDH1A1NPC1NFKB1RAB9ANFKB2 | |
| SCHEMBL8115238 | 0.86 | GPR119 (0.59) | ALDH1A1NPC1NFKB1RAB9ANFKB2 | |
| SCHEMBL8114017 | 0.74 | GPR119 (0.59) | GPR119 | |
| SCHEMBL8113514 | 0.73 | GPR119 (0.58) | ALDH1A1MAPTEPHX2KMT2AGPR119 | |
| SCHEMBL8119981 | 0.72 | ALDH1A1 (0.62) | ALDH1A1NPC1NFKB1RAB9ANFKB2 | |
| SCHEMBL19358916 | 0.72 | EPHX2 (0.68) | EPHX2EPHX1GPR119 | |
| SCHEMBL68529 | 0.72 | EPHX2 (0.51) | EPHX2HRH1CCR3 | |
| SCHEMBL3895250 | 0.71 | GPR119 (0.58) | EPHX2GPR119HRH1CCR3 | |
| SCHEMBL8120896 | 0.70 | GPR119 (0.52) | ALDH1A1P2RX7GPR119 | |
| Hydrochloric Acid SCHEMBL8104406 | 0.70 | F10 (0.64) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1020434-A1 | 3-AMIDINOANILINE DERIVATIVES, ACTIVATED BLOOD COAGULATION FACTOR X INHIBITORS, AND INTERMEDIATES FOR PRODUCING BOTH | Kissei Pharmaceutical Co., Ltd. (JP) | 2000-07-19 | — | — | EP | disclosed |