Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 12/20 | 0.64 |
| ▸ | ITGAV | P06756 | 12/20 | 0.64 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.64 |
| ▸ | ITGB6 | P18564 | 4/20 | 0.64 |
| ▸ | ITGB5 | P18084 | 4/20 | 0.64 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.45 |
| ▸ | TRPC4 | Q9UBN4 | 1/20 | 0.45 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.45 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.44 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7264202 | 0.83 | ITGB3 (0.70) | ITGB3ITGAVITGB1ITGB6ITGB5 | |
| SCHEMBL7264402 | 0.80 | ITGB3 (0.65) | ITGB3ITGAVITGB1ITGB6ITGB5 | |
| SCHEMBL6176984 | 0.80 | ITGB3 (0.80) | ITGB3ITGAVITGB1ITGB6ITGB5 | |
| SCHEMBL6176988 | 0.80 | ITGB3 (0.80) | ITGB3ITGAVITGB1ITGB6ITGB5 | |
| SCHEMBL6176963 | 0.78 | ITGB3 (1.00) | ITGB3ITGAVITGB1ITGB6ITGB5 | |
| SCHEMBL6176936 | 0.78 | ITGB3 (1.00) | ITGB3ITGAVITGB1ITGB6ITGB5 | |
| SCHEMBL6176461 | 0.78 | ITGB3 (1.00) | ITGB3ITGAVITGB1ITGB6ITGB5 | |
| SCHEMBL7264764 | 0.77 | ITGB1 (0.51) | ITGB1ITGA5NPC1RAB9AMAPT | |
| SCHEMBL7260158 | 0.77 | ITGB3 (0.76) | ITGB3ITGAVITGB1ITGB6ITGB5 | |
| SCHEMBL7264209 | 0.77 | ITGB3 (0.75) | ITGB3ITGAVITGB1ITGB6ITGB5 |
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-6645991-B1 | Glycoprotein adhesion receptor antagonists such as 3-phenyl-4-(4-(3-(pyridin-2-ylamino)propoxy)phenyl)-butyric acid, used for prophylaxis of tumors, osteoporosis, cardiovascular diseases, fibrosis, inflammation, infections or psoriasis | MERCK PATENT GMBH (DE) | 2003-11-11 | — | — | US | disclosed |