Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 1/20 | 0.40 |
| ▸ | CDC25B | P30305 | 3/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 9/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 3/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | PRKX | P51817 | 1/20 | 0.36 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | GRIA2 | P42262 | 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 | |
|---|---|---|---|---|
| SCHEMBL6933976 | 0.91 | ITGA4 (0.46) | ITGA4ITGB1 | |
| SCHEMBL6933788 | 0.89 | AGTR2 (0.39) | AGTR2CDC25BITGA4ITGB1S1PR1 | |
| SCHEMBL6934284 | 0.85 | ITGA4 (0.38) | ITGA4ITGB1S1PR1S1PR5 | |
| SCHEMBL6931687 | 0.85 | S1PR1 (0.43) | AGTR2CDC25BS1PR1S1PR5 | |
| SCHEMBL7709540 | 0.82 | NOS3 (0.43) | AGTR2ITGA4SLC7A5ITGB1 | |
| Hydrochloric Acid SCHEMBL6935551 | 0.82 | ITGA4 (0.41) | ITGA4ITGB1 | |
| SCHEMBL6934152 | 0.82 | ITGA4 (0.41) | ITGA4ITGB1 | |
| SCHEMBL6935180 | 0.81 | DPP4 (0.47) | SLC7A5S1PR5 | |
| SCHEMBL6933289 | 0.81 | PTPN1 (0.43) | ITGA4SLC7A5ITGB1PTPN1 | |
| Phenylalanine SCHEMBL7906184 | 0.80 | SLC7A5 (0.52) | SLC7A5 |
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-6362204-B1 | CONTROLLING IMMUNOLOGY; ANTIINFLAMMATORY AGENTS | CELLTECH THERAPEUTICS, LTD (GB) | 2002-03-26 | — | — | US | disclosed |