Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 7/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | KIT | P10721 | 5/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 4/20 | 0.43 |
| ▸ | CA12 | O43570 | 4/20 | 0.43 |
| ▸ | CA1 | P00915 | 4/20 | 0.43 |
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | FLT1 | P17948 | 3/20 | 0.43 |
| ▸ | FLT4 | P35916 | 3/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.43 |
| ▸ | CSF1R | P07333 | 2/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.43 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.43 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.43 |
| ▸ | PLK4 | O00444 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27958145 | 0.85 | KDR (0.41) | KDRCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27958168 | 0.85 | HDAC1 (0.40) | KDRCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27958144 | 0.78 | KDR (0.40) | KDRKITPDGFRAFLT1FLT4 | |
| SCHEMBL27958139 | 0.78 | MEN1 (0.42) | KDRCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27958133 | 0.77 | HDAC3 (0.37) | KDRCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27958135 | 0.76 | KDR (0.40) | KDRCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11859890 | 0.76 | CA2 (0.55) | CYP2C19CA12CA1CA2CA9 | |
| SCHEMBL27958142 | 0.75 | LIMK1 (0.37) | KDRCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27958143 | 0.75 | HDAC3 (0.35) | KDRCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27958141 | 0.74 | KDR (0.42) | KDRCYP3A4CYP2D6CYP2C9CYP2C19 |
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 |