Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.54 |
| ▸ | DRD4 | P21917 | 3/20 | 0.54 |
| ▸ | XIAP | P98170 | 1/20 | 0.54 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.54 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 6/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20733337 | 0.82 | XIAP (0.62) | DRD2DRD4XIAPBIRC2NOTUM | |
| SCHEMBL6960678 | 0.79 | DRD2 (0.58) | DRD2DRD4XIAPBIRC2NOTUM | |
| SCHEMBL20204804 | 0.79 | DRD2 (0.55) | DRD2DRD4XIAPBIRC2NOTUM | |
| SCHEMBL429841 | 0.77 | NOTUM (0.76) | DRD2DRD4XIAPBIRC2NOTUM | |
| SCHEMBL26691238 | 0.76 | NOTUM (0.55) | DRD2DRD4XIAPBIRC2NOTUM | |
| SCHEMBL20204802 | 0.75 | NOTUM (0.51) | DRD2DRD4XIAPBIRC2NOTUM | |
| SCHEMBL16301346 | 0.75 | NOTUM (0.51) | DRD2DRD4XIAPBIRC2NOTUM | |
| SCHEMBL25463664 | 0.74 | NOTUM (0.53) | DRD2DRD4XIAPBIRC2NOTUM | |
| SCHEMBL13354612 | 0.71 | NOTUM (0.53) | DRD2DRD4XIAPBIRC2NOTUM | |
| SCHEMBL23063860 | 0.70 | DRD2 (0.52) | DRD2DRD4XIAPBIRC2NOTUM |
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-2018098473-A1 | REAGENTS AND METHODS FOR ANALYSIS OF PROTEINS AND METABOLITES TARGETED BY COVALENT PROBES | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2018-05-31 | — | — | WO | disclosed |