Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 12/20 | 0.40 |
| ▸ | PARP1 | P09874 | 7/20 | 0.40 |
| ▸ | QPCT | Q16769 | 1/20 | 0.38 |
| ▸ | KIT | P10721 | 5/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 4/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27958137 | 0.86 | KDR (0.39) | KDRPARP1QPCTKITPDGFRA | |
| SCHEMBL27958131 | 0.85 | KDR (0.38) | KDRPARP1QPCTKITPDGFRA | |
| SCHEMBL27958145 | 0.82 | KDR (0.41) | KDRPARP1QPCTKITPDGFRA | |
| SCHEMBL27958168 | 0.82 | HDAC1 (0.40) | KDRPARP1QPCTKITPDGFRA | |
| SCHEMBL27958167 | 0.78 | KDR (0.46) | KDRPARP1QPCTKITPDGFRA | |
| SCHEMBL27958135 | 0.76 | KDR (0.40) | KDRPARP1QPCTKITPDGFRA | |
| SCHEMBL27958139 | 0.76 | MEN1 (0.42) | KDRQPCTKITPDGFRAHDAC3 | |
| SCHEMBL28217568 | 0.75 | GRM4 (0.43) | HDAC8 | |
| SCHEMBL27754771 | 0.75 | ESR1 (0.43) | HDAC8 | |
| SCHEMBL27958133 | 0.74 | HDAC3 (0.37) | KDRPARP1QPCTKITPDGFRA |
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-103739550-A | 2, 3-dimethyl-6-urea-2H-indazole compound and preparation method and application thereof | UNIV CHINA PHARMA | 2014-04-23 | — | — | CN | disclosed |