Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 8/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | HTR1A | P08908 | 1/20 | 0.67 |
| ▸ | MAOA | P21397 | 1/20 | 0.67 |
| ▸ | MAOB | P27338 | 1/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.67 |
| ▸ | HPGD | P15428 | 1/20 | 0.64 |
| ▸ | NAMPT | P43490 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL15947384 | 0.89 | CD274 (0.68) | CD274ALDH1A1HTR1AMAOAMAOB | |
| SCHEMBL19634439 | 0.88 | NPSR1 (0.67) | ALDH1A1HPGDNAMPTPOLBKDM4E | |
| SCHEMBL19634451 | 0.87 | NPSR1 (0.65) | ALDH1A1HPGDNAMPTPOLBKDM4E | |
| SCHEMBL19634416 | 0.87 | HDAC6 (0.69) | ALDH1A1NAMPTPOLB | |
| SCHEMBL21015948 | 0.87 | CD274 (0.62) | CD274ALDH1A1HTR1AMAOAMAOB | |
| SCHEMBL19634685 | 0.87 | CD274 (0.62) | CD274ALDH1A1HTR1AMAOAMAOB | |
| SCHEMBL23471125 | 0.86 | CYP2C19 (0.65) | CD274ALDH1A1HTR1AMAOAMAOB | |
| SCHEMBL8404677 | 0.86 | CD274 (0.71) | CD274ALDH1A1HTR1AMAOAMAOB | |
| SCHEMBL14853590 | 0.85 | CD274 (0.64) | CD274ALDH1A1HTR1AMAOAMAOB | |
| SCHEMBL23471160 | 0.85 | HASPIN (0.55) | ALDH1A1NAMPTPOLBKDM4E |
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-3831841-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T Global Inc. (US) | 2021-06-09 | — | — | EP | disclosed |
| WO-2017200984-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T GLOBAL INC. (US) | 2017-11-23 | — | — | WO | disclosed |