Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 15/20 | 0.61 |
| ▸ | ITGAV | P06756 | 13/20 | 0.61 |
| ▸ | ITGA2B | P08514 | 6/20 | 0.54 |
| ▸ | ITGB5 | P18084 | 3/20 | 0.50 |
| ▸ | ITGB6 | P18564 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.43 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7102335 | 0.90 | ITGB3 (0.61) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL7100379 | 0.85 | ITGB3 (0.60) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL12259092 | 0.83 | ITGB3 (0.68) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL7099770 | 0.77 | ITGB3 (0.47) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL8619040 | 0.75 | ITGB3 (0.52) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| Hydrochloric Acid SCHEMBL6947022 | 0.74 | GABBR2 (0.56) | ITGB3ITGA2BKDM4ERECQLMAPT | |
| SCHEMBL29050822 | 0.72 | MAPT (0.59) | ITGB3ITGAVKDM4ERECQLMAPT | |
| SCHEMBL12026728 | 0.72 | ITGB3 (0.54) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL7104922 | 0.72 | ITGB3 (0.89) | ITGB3ITGAVITGA2BITGB5ITGB6 | |
| SCHEMBL7099298 | 0.70 | ITGB3 (0.66) | ITGB3ITGAVITGA2BKDM4ERECQL |
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 |
|---|---|---|---|---|---|---|---|
| US-6649613-B1 | Integrin inhibitors | MERCK PATENT GMBH (DE) | 2003-11-18 | — | — | US | claimed |
| EP-1194401-B1 | DIACYLHYDRAZINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2003-09-10 | — | — | EP | claimed |
| US-6649613-B1 | Integrin inhibitors | MERCK PATENT GMBH (DE) | 2003-11-18 | — | — | US | disclosed |