Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.30 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2148965 | 0.82 | HDAC1 (0.31) | — | |
| SCHEMBL2149678 | 0.81 | — | — | |
| SCHEMBL3230025 | 0.81 | PTGDR2 (0.35) | — | |
| SCHEMBL4316385 | 0.79 | MEN1 (0.43) | MEN1KMT2ANOTUM | |
| SCHEMBL2149199 | 0.79 | ALDH1A1 (0.36) | MEN1KMT2AL3MBTL1MAP2K2MAP2K1 | |
| SCHEMBL2149741 | 0.79 | PTGDR2 (0.35) | — | |
| SCHEMBL2149083 | 0.78 | — | — | |
| SCHEMBL3242739 | 0.78 | — | — | |
| SCHEMBL3632665 | 0.78 | ABCB1 (0.50) | MEN1KMT2AL3MBTL1NOTUM | |
| SCHEMBL3244707 | 0.77 | KMT2A (0.38) | BRD4MEN1KMT2AMAP2K2MAP2K1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010028655-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2010-03-18 | — | — | WO | claimed |
| WO-2010028655-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2010-03-18 | — | — | WO | disclosed |