Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 2/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 4/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.35 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.34 |
| ▸ | SPR | P35270 | 3/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8867220 | 0.89 | ITGB3 (0.42) | HDAC4ATRHTR2BSMN1; SMN2HSD11B1 | |
| Trifluoroacetic Acid SCHEMBL9233271 | 0.87 | HDAC4 (0.36) | HDAC4ATRHTR2BF10PRSS1 | |
| Trifluoroacetic Acid SCHEMBL8866836 | 0.85 | F11 (0.40) | F10CHRM3 | |
| Trifluoroacetic Acid SCHEMBL9230148 | 0.79 | HPGDS (0.41) | HDAC4PARP1PARP2SMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL8866066 | 0.78 | GCGR (0.40) | — | |
| Trifluoroacetic Acid SCHEMBL8867403 | 0.76 | MAPT (0.43) | HDAC4ATRKCNH2SMN1; SMN2HSD11B1 | |
| Trifluoroacetic Acid SCHEMBL9233235 | 0.76 | HPGDS (0.42) | F10PRSS1PRSS2PRSS3ST14 | |
| Trifluoroacetic Acid SCHEMBL9235973 | 0.76 | SUV39H2 (0.43) | HDAC4 | |
| SCHEMBL9233214 | 0.74 | NPC1L1 (0.41) | — | |
| Trifluoroacetic Acid SCHEMBL9229650 | 0.74 | HPGDS (0.42) | F10PRSS1PRSS2PRSS3ST14 |
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-0668278-A1 | Adhesion receptor antagonists | MERCK PATENT GmbH (DE) | 1995-08-23 | — | — | EP | disclosed |