Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 10/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 4/20 | 0.34 |
| ▸ | MMP3 | P08254 | 3/20 | 0.34 |
| ▸ | MMP7 | P09237 | 3/20 | 0.34 |
| ▸ | MMP9 | P14780 | 3/20 | 0.34 |
| ▸ | MMP8 | P22894 | 3/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | PTPRC | P08575 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27821171 | 0.79 | REN (0.39) | KMT2AGAAMMP1MMP3MMP9 | |
| SCHEMBL1054142 | 0.79 | REN (0.39) | KMT2AGAAMMP1MMP3MMP9 | |
| SCHEMBL7433429 | 0.77 | ALDH1A1 (0.40) | KMT2AMEN1GAA | |
| SCHEMBL1349093 | 0.75 | AAK1 (0.48) | KMT2AMEN1GAAAAK1CTSS | |
| SCHEMBL1349095 | 0.75 | AAK1 (0.48) | KMT2AMEN1GAAAAK1CTSS | |
| SCHEMBL1273387 | 0.75 | AAK1 (0.48) | KMT2AMEN1GAAAAK1CTSS | |
| SCHEMBL1339541 | 0.74 | CYP2D6 (0.39) | KMT2AMEN1GAACTSSCTSK | |
| SCHEMBL2407746 | 0.74 | CYP2D6 (0.39) | KMT2AMEN1GAACTSSCTSK | |
| SCHEMBL2317242 | 0.74 | CYP2D6 (0.39) | KMT2AMEN1GAACTSSCTSK | |
| SCHEMBL2809508 | 0.74 | EPHX2 (0.44) | GAAAAK1 |
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-2011016576-A1 | ALANINE DERIVATIVES AS INHIBITORS OF APOPTOSIS PROTEINS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-02-10 | — | — | WO | disclosed |