Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 5/20 | 0.51 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.51 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.48 |
| ▸ | HPGDS | O60760 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8866136 | 0.96 | ITGB3 (0.49) | ITGB3ITGA2BPRSS1PRSS2PRSS3 | |
| Trifluoroacetic Acid SCHEMBL9229650 | 0.88 | HPGDS (0.42) | ITGB3ITGA2BPRSS1PRSS2PRSS3 | |
| Trifluoroacetic Acid SCHEMBL8866457 | 0.86 | ITGB3 (0.47) | ITGB3ITGA2BPRSS1PRSS2PRSS3 | |
| Trifluoroacetic Acid SCHEMBL9233235 | 0.85 | HPGDS (0.42) | ITGB3ITGA2BPRSS1PRSS2PRSS3 | |
| Trifluoroacetic Acid SCHEMBL8866276 | 0.84 | HPGDS (0.43) | ITGB3ITGA2BHPGDSSMN1; SMN2MAPT | |
| SCHEMBL8866605 | 0.83 | THRB (0.42) | PRSS1PRSS2PRSS3HPGDSSMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL8867174 | 0.83 | GPR6 (0.45) | HPGDSMAPTGAA | |
| SCHEMBL8865883 | 0.82 | PRSS1 (0.53) | ITGB3ITGA2BPRSS1PRSS2PRSS3 | |
| Water SCHEMBL8867564 | 0.81 | PRSS1 (0.52) | ITGB3ITGA2BPRSS1PRSS2PRSS3 | |
| Trifluoroacetic Acid SCHEMBL8866393 | 0.80 | ITGB3 (0.45) | ITGB3ITGA2BPRSS1PRSS2PRSS3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5614531-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-03-25 | — | — | US | disclosed |