Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CIT | O14578 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 9/20 | 0.39 |
| ▸ | MMP1 | P03956 | 8/20 | 0.39 |
| ▸ | MMP3 | P08254 | 7/20 | 0.39 |
| ▸ | MMP2 | P08253 | 8/20 | 0.38 |
| ▸ | MMP8 | P22894 | 6/20 | 0.38 |
| ▸ | KISS1R | Q969F8 | 3/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 3/20 | 0.36 |
| ▸ | MMP7 | P09237 | 2/20 | 0.35 |
| ▸ | MMP14 | P50281 | 2/20 | 0.35 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.35 |
| ▸ | MMP20 | O60882 | 1/20 | 0.35 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.35 |
| ▸ | TNF | P01375 | 1/20 | 0.35 |
| ▸ | MMP10 | P09238 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18520543 | 0.85 | MMP9 (0.38) | MMP9MMP1MMP3MMP2MMP8 | |
| SCHEMBL17992933 | 0.82 | KISS1R (0.37) | MMP9MMP1MMP3MMP2MMP8 | |
| SCHEMBL18520258 | 0.80 | MMP9 (0.36) | MMP9MMP1MMP3MMP2MMP8 | |
| SCHEMBL14731806 | 0.80 | MMP1 (0.39) | MMP9MMP1MMP3MMP2MMP8 | |
| SCHEMBL14731848 | 0.79 | MMP2 (0.40) | MMP9MMP1MMP3MMP2MMP8 | |
| SCHEMBL17920099 | 0.79 | MMP9 (0.37) | MMP9MMP1MMP3MMP2MMP8 | |
| SCHEMBL15186997 | 0.79 | MMP9 (0.35) | MMP9MMP1MMP3MMP2MMP8 | |
| SCHEMBL16021216 | 0.79 | MMP9 (0.35) | MMP9MMP1MMP3MMP2MMP8 | |
| SCHEMBL15187389 | 0.77 | MMP9 (0.37) | MMP9MMP1MMP3MMP2MMP8 | |
| SCHEMBL14161358 | 0.77 | MMP9 (0.36) | MMP9MMP1MMP3MMP2MMP8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017200984-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T GLOBAL INC. (US) | 2017-11-23 | — | — | WO | disclosed |