Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 6/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 6/20 | 0.35 |
| ▸ | ACLY | P53396 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 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 | |
|---|---|---|---|---|
| SCHEMBL7227210 | 1.00 | CNR1 (0.39) | CNR1MEN1KMT2AITGB1ITGA4 | |
| SCHEMBL7227199 | 1.00 | CNR1 (0.39) | CNR1MEN1KMT2AITGB1ITGA4 | |
| SCHEMBL7227630 | 0.79 | KMT2A (0.45) | CNR1MEN1KMT2AITGB1ITGA4 | |
| SCHEMBL7227628 | 0.79 | KMT2A (0.45) | CNR1MEN1KMT2AITGB1ITGA4 | |
| SCHEMBL7227633 | 0.79 | KMT2A (0.45) | CNR1MEN1KMT2AITGB1ITGA4 | |
| SCHEMBL21519754 | 0.77 | ITGB1 (0.49) | CNR1MEN1KMT2AITGB1ITGA4 | |
| SCHEMBL5201121 | 0.77 | ITGB1 (0.49) | CNR1MEN1KMT2AITGB1ITGA4 | |
| SCHEMBL5201582 | 0.75 | CNR1 (0.41) | CNR1MEN1KMT2AITGB1ITGA4 | |
| SCHEMBL5200881 | 0.75 | CNR1 (0.41) | CNR1MEN1KMT2AITGB1ITGA4 | |
| SCHEMBL5201586 | 0.75 | CNR1 (0.41) | CNR1MEN1KMT2AITGB1ITGA4 |
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-6645939-B1 | Very late antigen-4 (VLA) integrin antagonists; antiallergens, antiasthmatics, and antiinflammatory agents; multiple sclerosis, autoimmune disease treatment | MERCK & CO., INC. | 2003-11-11 | — | — | US | disclosed |