Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | CCR1 | P32246 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 3/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.40 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.40 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL19145431 | 1.00 | MEN1 (0.42) | MEN1KMT2AGPR55CASP1CCR1 | |
| SCHEMBL19145558 | 0.88 | MEN1 (0.44) | MEN1KMT2AGPR55CASP1CCR1 | |
| SCHEMBL19145111 | 0.88 | MEN1 (0.44) | MEN1KMT2AGPR55CASP1CCR1 | |
| SCHEMBL19145313 | 0.88 | CTSK (0.43) | CCR1CTSKITGB3ITGA2BBCHE | |
| SCHEMBL19145104 | 0.88 | P2RY12 (0.40) | MEN1KMT2AITGB3ITGA2BBCHE | |
| SCHEMBL19145314 | 0.85 | MEN1 (0.43) | MEN1KMT2AGPR55CASP1CCR1 | |
| SCHEMBL19145250 | 0.85 | MEN1 (0.43) | MEN1KMT2AGPR55CASP1CCR1 | |
| SCHEMBL19145341 | 0.83 | ALDH1A1 (0.45) | MEN1KMT2AGPR55CASP1ITGB3 | |
| SCHEMBL25087898 | 0.82 | FKBP1A (0.52) | MEN1KMT2AGPR55CASP1CTSK | |
| SCHEMBL10058359 | 0.82 | FKBP1A (0.52) | MEN1KMT2AGPR55CASP1CTSK |
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-2017123616-A1 | INHIBITING B-CELL LYMPHOMA 2 (BCL-2) AND RELATED PROTEINS | MERRIMACK PHARMACEUTICALS, INC. (US) | 2017-07-20 | — | — | WO | disclosed |