Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 2/20 | 0.49 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.49 |
| ▸ | ACLY | P53396 | 1/20 | 0.48 |
| ▸ | NOTUM | Q6P988 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17545148 | 0.89 | XIAP (0.53) | XIAPBIRC2ACLYNOTUMLMNA | |
| SCHEMBL17545284 | 0.83 | MEN1 (0.62) | XIAPBIRC2ACLYLMNAALDH1A1 | |
| SCHEMBL17545341 | 0.83 | LMNA (0.49) | XIAPBIRC2ACLYNOTUMLMNA | |
| SCHEMBL17545102 | 0.82 | NOTUM (0.49) | XIAPBIRC2ACLYNOTUMLMNA | |
| SCHEMBL17545361 | 0.81 | TSHR (0.59) | XIAPBIRC2ACLYNOTUMLMNA | |
| SCHEMBL5332602 | 0.81 | ACLY (0.53) | XIAPBIRC2ACLYNOTUMLMNA | |
| SCHEMBL14058949 | 0.81 | ACLY (0.53) | XIAPBIRC2ACLYNOTUMALDH1A1 | |
| SCHEMBL29707967 | 0.80 | ACLY (0.53) | XIAPBIRC2ACLYNOTUMALDH1A1 | |
| SCHEMBL1179278 | 0.80 | ACLY (0.53) | XIAPBIRC2ACLYNOTUMALDH1A1 | |
| SCHEMBL17545314 | 0.78 | TSHR (0.46) | XIAPBIRC2ACLYNOTUMLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3180312-B1 | INDOLINE SULFONAMIDE INHIBITORS OF DAPE AND NDM-1 AND USE OF THE SAME | UNIV LOYOLA CHICAGO (US) | 2019-10-16 | — | — | EP | disclosed |