Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | MMP9 | P14780 | 1/20 | 0.48 |
| ▸ | MMP12 | P39900 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | CXCL8 | P10145 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | RXRG | P48443 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4438683 | 0.86 | CYP2C9 (0.69) | HPGDCYP2C9CYP2C19MMP2MMP9 | |
| SCHEMBL4437147 | 0.84 | ALDH1A1 (0.46) | HPGDCYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL6935255 | 0.83 | AKR1B1 (0.55) | HPGDMMP2MMP9MMP12AKR1B1 | |
| Hydrochloric Acid SCHEMBL4556353 | 0.82 | ALDH1A1 (0.44) | HPGDCYP2C9CYP2C19LMNASMN1; SMN2 | |
| SCHEMBL3765157 | 0.78 | HPGD (0.78) | HPGDCYP2C9CYP2C19MMP2MMP9 | |
| SCHEMBL8590717 | 0.78 | CHRNA7 (0.49) | HPGDCYP2C9CYP2C19LMNASMN1; SMN2 | |
| SCHEMBL11402424 | 0.77 | CYP2C9 (0.51) | HPGDCYP2C9CYP2C19MMP2MMP9 | |
| SCHEMBL4441106 | 0.77 | CYP2C9 (0.58) | HPGDCYP2C9CYP2C19MMP2MMP9 | |
| SCHEMBL10937060 | 0.77 | CYP2C9 (0.67) | HPGDCYP2C9CYP2C19MMP2MMP9 | |
| SCHEMBL5659156 | 0.75 | IFNAR1 (0.62) | HPGDCYP2C9CYP2C19TDP1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2061754-A1 | BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS | XENON PHARMACEUTICALS INC. (CA) | 2009-05-27 | — | — | EP | disclosed |
| WO-2008115999-A1 | BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS | XENON PHARMACEUTICALS INC. (CA) | 2008-09-25 | — | — | WO | disclosed |