Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.50 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 4/20 | 0.42 |
| ▸ | DRD4 | P21917 | 4/20 | 0.42 |
| ▸ | DRD3 | P35462 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17978447 | 0.83 | CA12 (0.48) | CA12CA9SIRT2CXCR1DRD2 | |
| SCHEMBL1220104 | 0.82 | CA12 (0.52) | CA12CA9SIRT2CXCR1MAPT | |
| SCHEMBL2920882 | 0.82 | NOTUM (0.60) | CA12CA9SIRT2CXCR1MAPT | |
| SCHEMBL189588 | 0.82 | NOTUM (0.60) | CA12CA9SIRT2CXCR1MAPT | |
| SCHEMBL19403807 | 0.79 | CXCR1 (0.50) | CA12CA9SIRT2CXCR1MAPT | |
| SCHEMBL27789238 | 0.77 | NOTUM (0.66) | SIRT2MAPTNPC1RAB9ANOTUM | |
| SCHEMBL23881879 | 0.77 | NOTUM (0.64) | DRD2DRD4DRD3MAPTNPC1 | |
| SCHEMBL3822977 | 0.75 | GSK3B (0.51) | CA12CA9SIRT2CXCR1MAPT | |
| SCHEMBL16549592 | 0.74 | RAB9A (0.54) | CA12CA9CXCR1MAPTNPC1 | |
| SCHEMBL3459689 | 0.74 | CXCR1 (0.49) | CA12CA9CXCR1MAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102690241-B | Benzoyl urea compound containing isoxazoline and isoxazole structure, and preparation and application thereof | UNIV NANKAI | 2014-07-09 | — | — | CN | disclosed |
| CN-102690241-A | Benzoyl urea compound containing isoxazoline and isoxazole structure, and preparation and application thereof | UNIV NANKAI | 2012-09-26 | — | — | CN | disclosed |