Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 4/20 | 0.50 |
| ▸ | ITGA5 | P08648 | 4/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 15/20 | 0.48 |
| ▸ | ITGAV | P06756 | 15/20 | 0.48 |
| ▸ | ITGB6 | P18564 | 10/20 | 0.48 |
| ▸ | ITGB5 | P18084 | 3/20 | 0.48 |
| ▸ | ITGB8 | P26012 | 3/20 | 0.48 |
| ▸ | ITGA8 | P53708 | 3/20 | 0.48 |
| ▸ | GPR139 | Q6DWJ6 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7824431 | 1.00 | ITGB1 (0.50) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL7837326 | 0.92 | ITGB1 (0.57) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL6777689 | 0.92 | ITGB1 (0.57) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL7823048 | 0.91 | ITGB3 (0.48) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL6778158 | 0.91 | ITGB3 (0.48) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL6778294 | 0.88 | SLC6A9 (0.50) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL7824428 | 0.88 | SLC6A9 (0.50) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL244261 | 0.83 | ITGB3 (0.50) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL6774640 | 0.83 | ITGB3 (0.50) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL6777796 | 0.82 | ITGB3 (0.46) | ITGB1ITGA5ITGB3ITGAVITGB6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0850221-B1 | META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | SEARLE & CO (US) | 2001-07-18 | — | — | EP | claimed |
| US-6831199-B1 | In order to avoid bleeding side-effects when treating the conditions associated with integrin alpha v beta 3, it is beneficial to have compounds which are selective antagonists for alpha v beta 3 versus alpha IIb beta 3 | G. D. SEARLE & CO. | 2004-12-14 | — | — | US | disclosed |
| US-6028223-A | AN INTEGRIN ANTAGONISTS TREATING BONE DISORDER, PERIODONTAL DISEASE, OSTEOPOROSIS, HUMORAL HYPERCALCEMIA OF MALIGNANCY, PAGET'S DISEASE, TUMOR ANGIOGENESIS, DIABETIC RETINOPATHY, ARTHRITIS, SMOOTH MUSCLE CELL MIGRATION AND RESTENOSIS | G. D. SEARLE & CO. (US) | 2000-02-22 | — | — | US | disclosed |