Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 13/20 | 0.49 |
| ▸ | ITGA5 | P08648 | 10/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 7/20 | 0.49 |
| ▸ | ITGAV | P06756 | 7/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ITGB6 | P18564 | 3/20 | 0.39 |
| ▸ | ITGB5 | P18084 | 2/20 | 0.39 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TPH1 | P17752 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8234167 | 0.79 | ITGB1 (0.65) | ITGB1ITGA5ITGB3ITGAV | |
| SCHEMBL4068703 | 0.79 | ITGB1 (0.65) | ITGB1ITGA5ITGB3ITGAV | |
| SCHEMBL8234655 | 0.77 | ITGB1 (0.78) | ITGB1ITGA5ITGB3ITGAV | |
| SCHEMBL4068425 | 0.77 | ITGB1 (0.78) | ITGB1ITGA5ITGB3ITGAV | |
| SCHEMBL3019685 | 0.74 | SLC7A5 (0.37) | ITGB1ITGA5 | |
| SCHEMBL1324063 | 0.73 | DPP4 (0.39) | ITGB1ITGA5 | |
| SCHEMBL4064188 | 0.72 | ITGB1 (0.53) | ITGB1ITGA5ITGB3ITGAVITGB6 | |
| SCHEMBL297856 | 0.70 | RAB9A (0.42) | POLB | |
| SCHEMBL8234588 | 0.70 | ITGB1 (0.64) | ITGB1ITGA5ITGB3ITGAVKDM4E | |
| SCHEMBL4919562 | 0.69 | ITGB3 (0.67) | ITGB1ITGA5ITGB3ITGAVITGB6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2049490-A1 | N-(BENZOYL)-O- [2- (PYRIDIN- 2 -YLAMINO) ETHYL]-L-TYROSINE DERIVATIVES AND RELATED COMPOUNDS AS A5B1 ANTAGONISTS FOR THE TREATMENT OF SOLID TUMORS | Astra Zeneca AB (SE) | 2009-04-22 | — | — | EP | claimed |
| WO-2007141473-A1 | N-(BENZOYL)-O- [2- (PYRIDIN- 2 -YLAMINO) ETHYL] -L-TYROSINE DERIVATIVES AND RELATED COMPOUNDS AS A5B1 ANTAGONISTS FOR THE TREATMENT OF SOLID TUMORS | ASTRAZENECA AB (SE) | 2007-12-13 | — | — | WO | claimed |