Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.38 |
| ▸ | ESR1 | P03372 | 4/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19914344 | 0.82 | ESR1 (0.40) | AHRESR1ESR2LMNACYP1A2 | |
| SCHEMBL6010846 | 0.82 | LMNA (0.38) | ESR1ESR2LMNAALDH1A1 | |
| SCHEMBL16391572 | 0.80 | PGK1 (0.44) | KMO | |
| SCHEMBL19914412 | 0.80 | PGK1 (0.44) | ALDH1A1 | |
| SCHEMBL29672287 | 0.78 | LRRK2 (0.38) | ESR1ESR2CYP1A2 | |
| SCHEMBL19914377 | 0.78 | LRRK2 (0.38) | ESR1ESR2CYP1A2 | |
| SCHEMBL11063958 | 0.76 | PIK3CG (0.59) | LMNAALDH1A1CYP1A2MAPTTHRB | |
| SCHEMBL3568640 | 0.76 | CA1 (0.42) | LMNA | |
| SCHEMBL6497225 | 0.76 | LMNA (0.63) | LMNAALDH1A1MAPTMAPK1 | |
| SCHEMBL19914339 | 0.76 | AHR (0.42) | AHRESR1ESR2HDAC7HDAC11 |
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 |
|---|---|---|---|---|---|---|---|
| JP-54066673-A | — | — | None | — | — | JP | disclosed |
| JP-S5466673-A | BENZOXAZOLE COMPOUND AND HERBICIDE CONTAINING THE SAME | MITSUI TOATSU CHEM INC | 1979-05-29 | — | — | JP | disclosed |