Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.45 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.45 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.45 |
| ▸ | TTR | P02766 | 2/20 | 0.43 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL10884469 | 0.88 | CYP3A4 (0.58) | GPR35ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL7021569 | 0.84 | GPR35 (0.72) | GPR35ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL1600577 | 0.84 | GPR35 (0.57) | GPR35ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL8375683 | 0.83 | TTR (0.53) | GPR35ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL8373355 | 0.82 | GPR35 (0.57) | GPR35ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL10886742 | 0.78 | GPR35 (0.59) | GPR35ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL5313614 | 0.78 | TTR (0.47) | GPR35ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL11700763 | 0.78 | CYP3A4 (0.51) | GPR35ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL11700770 | 0.78 | CYP3A4 (0.51) | GPR35ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL1515898 | 0.77 | XDH (0.63) | GPR35ALDH1A1HPGDTTRXDH |
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 |
|---|---|---|---|---|---|---|---|
| JP-2001048844-A | BIS(4-HYDROXY-3-NITRO-5-PERFLUOROALKYLPHENYL)FLUORO- ALKANE AND ITS PRODUCTION | DAIKIN IND LTD | 2001-02-20 | — | — | JP | disclosed |