Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 13/20 | 0.42 |
| ▸ | ITGAV | P06756 | 13/20 | 0.42 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.38 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | ALPI | P09923 | 1/20 | 0.36 |
| ▸ | ALPG | P10696 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.35 |
| ▸ | TRPC4 | Q9UBN4 | 1/20 | 0.35 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6504314 | 0.91 | ITGB3 (0.44) | ITGB3ITGAVITGB1ITGA5BCHE | |
| SCHEMBL6495002 | 0.90 | ITGB3 (0.41) | ITGB3ITGAVITGB1ITGA5BCHE | |
| SCHEMBL6503005 | 0.89 | ITGB3 (0.51) | ITGB3ITGAVITGB1ITGA5ALPL | |
| SCHEMBL6495597 | 0.86 | ITGB3 (0.39) | ITGB3ITGAV | |
| SCHEMBL3048231 | 0.85 | ITGB3 (0.45) | ITGB3ITGAVITGB1ITGA5BCHE | |
| SCHEMBL6496052 | 0.83 | ITGB1 (0.47) | ITGB3ITGAVITGB1ITGA5 | |
| SCHEMBL5204539 | 0.82 | ITGB3 (0.41) | ITGB3ITGAVITGB1ITGA5BCHE | |
| SCHEMBL14431792 | 0.81 | BCHE (0.37) | ITGB3ITGAVITGB1ITGA5BCHE | |
| SCHEMBL6506524 | 0.78 | ITGB3 (0.40) | ITGB3ITGAVITGB1ITGA5 | |
| SCHEMBL6505728 | 0.76 | ITGB3 (0.49) | ITGB3ITGAV |
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-6849646-B1 | Chromenone and chromanone derivatives as integrin inhibitors | MERCK PATENT GMBH (DE) | 2005-02-01 | — | — | US | disclosed |
| EP-1124824-A1 | CHROMENONE AND CHROMANONE DERIVATIVES AS INTEGRIN INHIBITORS | MERCK PATENT GmbH (DE) | 2001-08-22 | — | — | EP | disclosed |
| WO-2000026212-A1 | CHROMENONE AND CHROMANONE DERIVATIVES AS INTEGRIN INHIBITORS | MERCK PATENT GMBH (DE) | 2000-05-11 | — | — | WO | disclosed |