Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | CPA1 | P15085 | 1/20 | 0.39 |
| ▸ | CPA2 | P48052 | 1/20 | 0.39 |
| ▸ | CPA4 | Q9UI42 | 1/20 | 0.39 |
| ▸ | REN | P00797 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.37 |
| ▸ | VHL | P40337 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | XIAP | P98170 | 1/20 | 0.36 |
| ▸ | NTMT1 | Q9BV86 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 2/20 | 0.36 |
| ▸ | MMP1 | P03956 | 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 | |
|---|---|---|---|---|
| SCHEMBL21553671 | 0.80 | XIAP (0.42) | F2OPRM1OPRD1OPRK1XIAP | |
| SCHEMBL19819645 | 0.80 | F2 (0.32) | F2ITGB1ITGA4OPRM1 | |
| SCHEMBL406540 | 0.77 | P2RX7 (0.45) | F2P2RX7CPA1CPA2CPA4 | |
| SCHEMBL10136486 | 0.77 | P2RX7 (0.45) | F2P2RX7CPA1CPA2CPA4 | |
| SCHEMBL12258952 | 0.77 | P2RX7 (0.45) | F2P2RX7CPA1CPA2CPA4 | |
| SCHEMBL18098145 | 0.77 | F2 (0.50) | F2ITGB1ITGA4P2RX7OPRM1 | |
| SCHEMBL31181175 | 0.76 | ITGB1 (0.52) | F2ITGB1ITGA4P2RX7OPRM1 | |
| SCHEMBL19681252 | 0.76 | F2 (0.43) | F2ITGB1ITGA4P2RX7REN | |
| SCHEMBL19685306 | 0.75 | F2 (0.52) | F2OPRM1VHLNTMT1 | |
| SCHEMBL30121019 | 0.75 | ACE (0.49) | F2ITGB1ITGA4OPRM1CPA1 |
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-3626732-A1 | MACROCYCLIC INHIBITORS OF THE PD-1/PD-L1 AND CD80(B7-1)/PD-L1 PROTEIN/PROTEIN INTERACTIONS | Bristol-Myers Squibb Company (US) | 2020-03-25 | — | — | EP | disclosed |
| EP-2970390-B1 | MACROCYCLIC INHIBITORS OF THE PD-1/PD-L1 AND CD80(B7-1)/PD-L1 PROTEIN/PROTEIN INTERACTIONS | BRISTOL MYERS SQUIBB CO (US) | 2019-11-06 | — | — | EP | disclosed |