Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 3/20 | 0.45 |
| ▸ | MMP13 | P45452 | 3/20 | 0.45 |
| ▸ | MMP12 | P39900 | 2/20 | 0.45 |
| ▸ | MMP1 | P03956 | 2/20 | 0.45 |
| ▸ | MMP7 | P09237 | 1/20 | 0.45 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.44 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.39 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28388563 | 0.83 | CA1 (0.52) | MMP8MMP13MMP1GLO1CA2 | |
| SCHEMBL426661 | 0.79 | IDO1 (0.56) | IDO1MMP8MMP13MMP12MMP1 | |
| SCHEMBL8987446 | 0.74 | IDO1 (0.59) | IDO1MMP8MMP13MMP12MMP1 | |
| SCHEMBL6488752 | 0.74 | IDO1 (0.63) | IDO1MMP8MMP13MMP12MMP1 | |
| SCHEMBL426660 | 0.72 | IDO1 (0.56) | IDO1MMP8MMP13MMP12MMP1 | |
| SCHEMBL6793104 | 0.71 | IDO1 (0.59) | IDO1MMP8MMP13MMP12MMP1 | |
| SCHEMBL16914880 | 0.71 | MMP8 (0.64) | IDO1MMP8MMP13MMP12MMP1 | |
| SCHEMBL10890460 | 0.71 | IDO1 (0.59) | IDO1MMP8MMP13MMP12MMP1 | |
| SCHEMBL15754219 | 0.69 | L3MBTL1 (0.64) | IDO1MMP8MMP13MMP12MMP1 | |
| SCHEMBL15622087 | 0.69 | IDO1 (0.68) | IDO1MMP8MMP13MMP12MMP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110452143-B | Method for mildly and efficiently synthesizing 1, 3-disulfide derivative | 西南民族大学 | 2020-04-28 | — | — | CN | disclosed |