Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4A | O75164 | 1/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 11/20 | 0.43 |
| ▸ | ITGAV | P06756 | 10/20 | 0.43 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.43 |
| ▸ | ITGA5 | P08648 | 4/20 | 0.43 |
| ▸ | ITGB5 | P18084 | 4/20 | 0.43 |
| ▸ | CTSG | P08311 | 2/20 | 0.41 |
| ▸ | ITGB6 | P18564 | 2/20 | 0.41 |
| ▸ | ITGB8 | P26012 | 2/20 | 0.41 |
| ▸ | MC4R | P32245 | 4/20 | 0.41 |
| ▸ | MC5R | P33032 | 4/20 | 0.41 |
| ▸ | MC3R | P41968 | 4/20 | 0.41 |
| ▸ | MC1R | Q01726 | 4/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | NNMT | P40261 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8366260 | 0.94 | AVPR2 (0.42) | ITGB3ITGAVITGB1ITGA5ITGB5 | |
| SCHEMBL8365687 | 0.94 | AVPR2 (0.42) | ITGB3ITGAVITGB1ITGA5ITGB5 | |
| SCHEMBL8365685 | 0.93 | AVPR2 (0.43) | ITGB3ITGAVITGB1ITGA5ITGB5 | |
| SCHEMBL14585800 | 0.93 | KDM4A (0.43) | KDM4AITGB3ITGAVITGB1ITGA5 | |
| SCHEMBL7746128 | 0.93 | KDM4A (0.43) | KDM4AITGB3ITGAVITGB1ITGA5 | |
| SCHEMBL7738154 | 0.93 | KDM4A (0.43) | KDM4AITGB3ITGAVITGB1ITGA5 | |
| SCHEMBL8364168 | 0.93 | ITGB3 (0.42) | KDM4AITGB3ITGAVITGB1ITGA5 | |
| SCHEMBL8366358 | 0.92 | ITGB3 (0.40) | KDM4AITGB3ITGAVITGB1ITGA5 | |
| SCHEMBL8366264 | 0.91 | ITGB3 (0.42) | ITGB3ITGAVITGB1ITGA5ITGB5 | |
| SCHEMBL8365734 | 0.90 | ITGB3 (0.46) | ITGB3ITGAVITGB1ITGA5ITGB5 |
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-6537520-B1 | Diagnosis and treatment of cancer; kit containing compound having peptide or peptidomimetic functionality that binds to a alpha v beta 3 receptor linked to a chelator | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2003-03-25 | — | — | US | disclosed |