Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 5/20 | 0.71 |
| ▸ | PPIA | P62937 | 17/20 | 0.66 |
| ▸ | PPIB | P23284 | 11/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.66 |
| ▸ | PPIF | P30405 | 2/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.66 |
| ▸ | SLCO1B1 | Q9Y6L6 | 5/20 | 0.62 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.62 |
| ▸ | ABCC2 | Q92887 | 2/20 | 0.62 |
| ▸ | SLCO1B3 | Q9NPD5 | 2/20 | 0.62 |
| ▸ | FPR1 | P21462 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.60 |
| ▸ | GMNN | O75496 | 1/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.60 |
| ▸ | SLCO2B1 | O94956 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL20076329 | 1.00 | ABCB1 (0.71) | ABCB1PPIAPPIBCYP3A4CYP2C9 | |
| SCHEMBL20076328 | 0.96 | ABCB1 (0.67) | ABCB1PPIAPPIBCYP3A4CYP2C9 | |
| SCHEMBL20076377 | 0.95 | ABCB1 (0.70) | ABCB1PPIAPPIBCYP3A4CYP2C9 | |
| SCHEMBL20076387 | 0.94 | PPIA (0.75) | ABCB1PPIAPPIBCYP3A4CYP2C9 | |
| SCHEMBL19861299 | 0.94 | ABCB1 (0.71) | ABCB1PPIAPPIBCYP3A4CYP2C9 | |
| SCHEMBL19861297 | 0.94 | ABCB1 (0.71) | ABCB1PPIAPPIBCYP3A4CYP2C9 | |
| SCHEMBL15182895 | 0.92 | PPIA (0.78) | ABCB1PPIAPPIBCYP3A4CYP2C9 | |
| SCHEMBL15182908 | 0.92 | PPIA (0.78) | ABCB1PPIAPPIBCYP3A4CYP2C9 | |
| SCHEMBL1708953 | 0.92 | PPIA (0.78) | ABCB1PPIAPPIBCYP3A4CYP2C9 | |
| SCHEMBL18520565 | 0.91 | PPIA (0.77) | ABCB1PPIAPPIBCYP3A4CYP2C9 |
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-9890198-B2 | Cyclosporin derivatives and uses thereof | S&T GLOBAL INC. (US) | 2018-02-13 | — | — | US | disclosed |