Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 8/20 | 0.36 |
| ▸ | F10 | P00742 | 2/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL7188554 | 0.91 | F2 (0.36) | F2F10PRSS2MCL1LMNA | |
| SCHEMBL6888564 | 0.87 | NPC1 (0.39) | ALDH1A1F2MAPTL3MBTL1LMNA | |
| SCHEMBL6890192 | 0.87 | MAPK1 (0.37) | ALDH1A1F2F10PRSS2MAPT | |
| SCHEMBL6890596 | 0.86 | F2 (0.39) | ALDH1A1PKMF2F10PRSS2 | |
| SCHEMBL6752905 | 0.81 | F2 (0.41) | F2F10PRSS2 | |
| SCHEMBL6745651 | 0.78 | F2 (0.40) | F2F10PRSS2 | |
| SCHEMBL6747439 | 0.78 | F2 (0.41) | F2F10PRSS2 | |
| SCHEMBL7931212 | 0.77 | F2 (0.40) | F2F10PRSS2LMNA | |
| Hydrochloric Acid SCHEMBL7934197 | 0.77 | F2 (0.41) | F2F10PRSS2 | |
| SCHEMBL6888647 | 0.77 | F2 (0.39) | F2F10PRSS2LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6730783-B2 | REACTING AMINOGUANIDINE WITH CARBONYL COMPOUND TO FORM AMIDINOHYDRAZONE; REDUCTION; REACTING WITH ALKOXYAMINE; GUANIDINYLATION; ANTICOAGULANTS | 3-DIMENSIONAL PHARMACEUTICALS, INC. | 2004-05-04 | — | — | US | disclosed |
| US-6638931-B1 | Aminoguanidines and alkoxyguanidines as protease inhibitors | 3-DIMENSIONAL PHARMACEUTICALS, INC. | 2003-10-28 | — | — | US | disclosed |
| US-6235778-B1 | ANTICOAGULANTS | 3-DIMENSIONAL PHARMACEUTICALS, INC. | 2001-05-22 | — | — | US | disclosed |