Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.70 |
| ▸ | HPGD | P15428 | 4/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.70 |
| ▸ | MAPT | P10636 | 11/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | CASP1 | P29466 | 1/20 | 0.61 |
| ▸ | AHR | P35869 | 1/20 | 0.61 |
| ▸ | CASP7 | P55210 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | RAD52 | P43351 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL6512019 | 0.84 | KDM4E (0.86) | KDM4EALDH1A1HPGDCYP1A2CYP2C19 | |
| SCHEMBL6513981 | 0.81 | KDM4E (0.70) | KDM4EALDH1A1HPGDCYP1A2CYP2C19 | |
| SCHEMBL5910684 | 0.80 | KMT2A (0.72) | KDM4EALDH1A1HPGDMAPTL3MBTL1 | |
| SCHEMBL4215600 | 0.78 | HRH3 (0.67) | KDM4EALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL5909889 | 0.78 | MAPT (0.86) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL5910416 | 0.75 | POLB (0.82) | KDM4EALDH1A1HPGDMAPTL3MBTL1 | |
| SCHEMBL6229712 | 0.75 | ALDH1A1 (0.61) | KDM4EALDH1A1HPGDCYP1A2CYP2C19 | |
| SCHEMBL5910106 | 0.74 | MAPT (0.60) | KDM4EALDH1A1HPGDMAPTL3MBTL1 | |
| SCHEMBL5909997 | 0.74 | MCHR1 (0.84) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| Hydrochloric Acid SCHEMBL6231608 | 0.74 | ALDH1A1 (0.60) | KDM4EALDH1A1HPGDCYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005087742-A1 | METABOLIC KINASE MODULATORS AND METHODS OF USE AS PESTICIDES | EXELIXIS, INC. (US) | 2005-09-22 | — | — | WO | claimed |
| WO-2005087742-A1 | METABOLIC KINASE MODULATORS AND METHODS OF USE AS PESTICIDES | EXELIXIS, INC. (US) | 2005-09-22 | — | — | WO | disclosed |