Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | DRD2 | P14416 | 1/20 | 0.61 |
| ▸ | DRD3 | P35462 | 1/20 | 0.61 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.60 |
| ▸ | HTR2C | P28335 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.58 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.58 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.58 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.58 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.58 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.58 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL30102647 | 0.85 | NAMPT (0.63) | KDM4EHSD17B10ALDH1A1DRD2DRD3 | |
| SCHEMBL17209330 | 0.84 | CA12 (0.77) | KDM4EHSD17B10ALDH1A1DRD2DRD3 | |
| SCHEMBL16017609 | 0.83 | HDAC2 (0.81) | KDM4EHSD17B10ALDH1A1HDAC3HDAC1 | |
| SCHEMBL27908704 | 0.83 | PLCG2 (0.61) | KDM4EHSD17B10ALDH1A1DRD2DRD3 | |
| SCHEMBL27908702 | 0.82 | KDM4E (0.58) | KDM4EHSD17B10ALDH1A1DRD2DRD3 | |
| SCHEMBL27550290 | 0.81 | AKR1C3 (0.86) | KDM4EHSD17B10ALDH1A1DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL20267092 | 0.80 | KDM4E (0.82) | KDM4EHSD17B10ALDH1A1DRD2DRD3 | |
| SCHEMBL29904432 | 0.79 | KDM4E (0.83) | KDM4EHSD17B10ALDH1A1DRD2DRD3 | |
| SCHEMBL28081972 | 0.79 | KDM4E (0.72) | KDM4EALDH1A1HDAC3HDAC4HDAC1 | |
| SCHEMBL6632042 | 0.79 | KDM4E (0.71) | KDM4EHSD17B10ALDH1A1DRD2DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102153515-B | N,N'-bis-substituted urea Raf kinase inhibitors and preparation method and application thereof | UNIV CHINA PHARMA | 2013-02-27 | — | — | CN | disclosed |