Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 15/20 | 0.62 |
| ▸ | ITGAV | P06756 | 15/20 | 0.62 |
| ▸ | ITGA2B | P08514 | 6/20 | 0.60 |
| ▸ | ITGB5 | P18084 | 3/20 | 0.60 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.60 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30446097 | 0.86 | ITGB3 (0.73) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL4394126 | 0.85 | ITGB3 (0.64) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL5846445 | 0.83 | ITGB3 (0.62) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL8180590 | 0.83 | ITGB3 (0.62) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL18381352 | 0.83 | ITGB3 (0.62) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL5845065 | 0.83 | ITGB3 (0.59) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL2037116 | 0.81 | ITGB3 (0.70) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL7039474 | 0.80 | ITGAV (0.57) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL5844128 | 0.80 | ITGB3 (0.52) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL5845136 | 0.80 | ITGB3 (0.55) | ITGB3ITGAVITGA2BITGB5ITGB6 |
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-6576637-B1 | Such as 3-(4-methyl-3-nitrophenyl)-3-(2-(4-(pyridin-2-yl-amino)butyryl amino)acetylamino)propionic acid; thrombosis, heart infarct, coronary heart diseases, arteriosclerosis, inflammations, | MERCK PATENT GMBH (DE) | 2003-06-10 | — | — | US | disclosed |