Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 4/20 | 0.33 |
| ▸ | CTSS | P25774 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13997582 | 0.89 | TDP1 (0.42) | TDP1MEN1KMT2AGAAMAPT | |
| SCHEMBL22156688 | 0.85 | CTSK (0.45) | TDP1MEN1KMT2AGAAMAPT | |
| SCHEMBL2611916 | 0.85 | GRN (0.36) | TDP1MEN1KMT2AGAAMAPT | |
| SCHEMBL23901484 | 0.84 | MEN1 (0.35) | TDP1MEN1KMT2AGAAMAPT | |
| SCHEMBL27897841 | 0.84 | MEN1 (0.35) | TDP1MEN1KMT2AGAAMAPT | |
| SCHEMBL14742867 | 0.83 | MEN1 (0.38) | TDP1MEN1KMT2AGAAMAPT | |
| SCHEMBL3400833 | 0.83 | MEN1 (0.34) | TDP1MEN1KMT2AGAAMAPT | |
| SCHEMBL6296123 | 0.81 | CTSK (0.47) | TDP1MEN1KMT2AGAACTSK | |
| SCHEMBL22316568 | 0.81 | ANPEP (0.42) | MEN1KMT2AGAAITGA4ITGB7 | |
| SCHEMBL9506355 | 0.81 | CTSK (0.50) | CTSKCTSSCA1CA2 |
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-2018045246-A1 | CXCR3 RECEPTOR AGONISTS | CELGENE INTERNATIONAL II SARL (CH) | 2018-03-08 | — | — | WO | disclosed |