Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 3/20 | 0.47 |
| ▸ | ITGAV | P06756 | 3/20 | 0.47 |
| ▸ | MMP12 | P39900 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | PDE2A | O00408 | 4/20 | 0.37 |
| ▸ | IGF2BP2 | Q9Y6M1 | 1/20 | 0.36 |
| ▸ | FPR2 | P25090 | 1/20 | 0.36 |
| ▸ | F9 | P00740 | 1/20 | 0.35 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.35 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.35 |
| ▸ | ITGB8 | P26012 | 1/20 | 0.35 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.34 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7099303 | 0.87 | KDM4E (0.43) | ITGB3ITGAVITGB5ITGB6 | |
| SCHEMBL7104747 | 0.84 | CTSA (0.42) | ITGB3ITGAV | |
| SCHEMBL7100980 | 0.84 | ITGB3 (0.42) | ITGB3ITGAV | |
| SCHEMBL7105223 | 0.83 | ITGB3 (0.55) | ITGB3ITGAVMMP12F9 | |
| SCHEMBL7104880 | 0.80 | ITGB3 (0.43) | ITGB3ITGAV | |
| SCHEMBL7103717 | 0.76 | ITGB3 (0.46) | ITGB3ITGAV | |
| SCHEMBL7099306 | 0.69 | ITGB3 (0.51) | ITGB3ITGAV | |
| SCHEMBL7099318 | 0.69 | ITGB3 (0.42) | ITGB3ITGAVITGB5ITGB6 | |
| SCHEMBL7105186 | 0.67 | ITGB3 (0.57) | ITGB3ITGAV | |
| SCHEMBL7099324 | 0.67 | ITGB3 (0.41) | ITGB3ITGAVITGB1ITGA4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6649613-B1 | Integrin inhibitors | MERCK PATENT GMBH (DE) | 2003-11-18 | — | — | US | disclosed |
| EP-1194401-B1 | DIACYLHYDRAZINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2003-09-10 | — | — | EP | disclosed |