Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGAM | O43451 | 1/20 | 0.52 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 3/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.48 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.48 |
| ▸ | ITGAL | P20701 | 1/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.47 |
| ▸ | CCR1 | P32246 | 1/20 | 0.47 |
| ▸ | CCKBR | P32239 | 1/20 | 0.46 |
| ▸ | CFTR | P13569 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.46 |
| ▸ | GRN | P28799 | 1/20 | 0.46 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7340288 | 0.84 | TAS1R3 (0.59) | BCAT1CA2CA1ITGB2ICAM1 | |
| SCHEMBL7339828 | 0.80 | GRN (0.70) | ITGB2ICAM1ITGALCCR1GRN | |
| SCHEMBL5280601 | 0.78 | CA2 (0.68) | CA2CA1ITGB2ICAM1ITGAL | |
| SCHEMBL5191250 | 0.78 | CA2 (0.68) | CA2CA1ITGB2ICAM1ITGAL | |
| SCHEMBL7332048 | 0.78 | ITGB2 (0.50) | CA2CA1ITGB2ICAM1ITGAL | |
| SCHEMBL6237473 | 0.77 | MGAM (0.65) | MGAMBCAT1CCR1CFTRKDR | |
| SCHEMBL12043740 | 0.76 | HPGDS (0.67) | MGAMBCAT1CCR1KDR | |
| SCHEMBL6444839 | 0.76 | ALDH1A1 (0.58) | MGAMCA2ITGB2ICAM1ITGAL | |
| SCHEMBL561849 | 0.76 | ALDH1A1 (0.58) | MGAMCA2ITGB2ICAM1ITGAL | |
| SCHEMBL9233015 | 0.76 | MEN1 (0.48) | CA2CA1ITGB2ICAM1ITGAL |
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-5545640-A | VIRICIDES, HIV; AIDS | BIO-MEGA/BOEHRINGER INGELEHEIM RESEARCH INC. (CA) | 1996-08-13 | — | — | US | disclosed |