Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 3/20 | 0.41 |
| ▸ | CETP | P11597 | 1/20 | 0.39 |
| ▸ | MME | P08473 | 1/20 | 0.39 |
| ▸ | CPA1 | P15085 | 1/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
| ▸ | FPR2 | P25090 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 4/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 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 | |
|---|---|---|---|---|
| SCHEMBL2388025 | 0.94 | USP2 (0.42) | ACEFPR2ITGA4ITGB7TP53 | |
| SCHEMBL2385452 | 0.93 | NOS3 (0.42) | ACECETPMMECPA1ACE2 | |
| SCHEMBL2386285 | 0.93 | FPR2 (0.44) | ACEMMECPA1ACE2FPR2 | |
| SCHEMBL2386632 | 0.91 | ITGA4 (0.45) | ACEITGA4ITGB7KMT2ATP53 | |
| SCHEMBL2386953 | 0.90 | MME (0.41) | ACEMMECPA1ACE2FPR2 | |
| SCHEMBL2385883 | 0.89 | TACR1 (0.43) | ACEITGA4ITGB7TACR1KMT2A | |
| SCHEMBL2384179 | 0.87 | ALDH1A1 (0.46) | ACEMMEITGA4ITGB7KMT2A | |
| SCHEMBL2387347 | 0.87 | ITGA4 (0.42) | ACEMMEITGA4ITGB7MMP8 | |
| SCHEMBL2385838 | 0.87 | ITGA4 (0.42) | ACEMMEITGA4ITGB7MMP8 | |
| SCHEMBL2385007 | 0.86 | EPHX2 (0.44) | ITGA4ITGB7 |
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-8017378-B2 | Method for production of optically active biphenylalanine compound or salt or ester thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-09-13 | — | — | US | disclosed |