Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 5/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | COMT | P21964 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3632665 | 0.91 | ABCB1 (0.50) | MEN1KMT2AABCB1NOTUMALDH1A1 | |
| SCHEMBL3633358 | 0.90 | NOTUM (0.44) | MEN1KMT2AABCB1NOTUMALDH1A1 | |
| SCHEMBL1551329 | 0.88 | AKR1C3 (0.37) | MEN1KMT2AABCB1LMNA | |
| SCHEMBL3634622 | 0.87 | NOTUM (0.45) | MEN1KMT2ANOTUMKDM4EATM | |
| SCHEMBL3634031 | 0.87 | PLA2G4A (0.35) | MEN1KMT2AMAPK1 | |
| SCHEMBL3632614 | 0.86 | MEN1 (0.45) | MEN1KMT2AABCB1NOTUMMAPK1 | |
| SCHEMBL3629049 | 0.84 | MEN1 (0.43) | MEN1KMT2AABCB1NOTUMMAPK1 | |
| SCHEMBL1032110 | 0.84 | MEN1 (0.43) | MEN1KMT2AABCB1NOTUMMAPK1 | |
| SCHEMBL1550103 | 0.83 | SMN1; SMN2 (0.39) | MEN1KMT2AGAAKDM4ELMNA | |
| SCHEMBL4284158 | 0.82 | ABCB1 (0.37) | ABCB1 |
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-2009130240-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2009-10-29 | — | — | WO | claimed |
| WO-2009130240-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2009-10-29 | — | — | WO | disclosed |