Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.32 |
| ▸ | TSHR | P16473 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1224647 | 0.98 | TDP1 (0.34) | TDP1CYP3A4TSHRALDH1A1HPGD | |
| SCHEMBL1823532 | 0.84 | TDP1 (0.40) | TDP1CYP3A4TSHRALDH1A1HPGD | |
| SCHEMBL795913 | 0.84 | GABRA1 (0.39) | TDP1CYP3A4TSHRALDH1A1SLC6A2 | |
| SCHEMBL1954434 | 0.83 | SKP2 (0.39) | CYP3A4TSHRALDH1A1HPGDHSD17B10 | |
| SCHEMBL8918996 | 0.82 | TDP1 (0.42) | TDP1TSHRALDH1A1HPGDHSD17B10 | |
| SCHEMBL9843984 | 0.82 | CYP3A4 (0.36) | TDP1CYP3A4TSHRALDH1A1HPGD | |
| SCHEMBL28159108 | 0.80 | CYP3A4 (0.39) | TDP1CYP3A4TSHRALDH1A1HPGD | |
| SCHEMBL992770 | 0.78 | CD44 (0.39) | TDP1CYP3A4TSHRALDH1A1HPGD | |
| SCHEMBL30645118 | 0.78 | CD44 (0.39) | TDP1CYP3A4TSHRALDH1A1HPGD | |
| SCHEMBL249418 | 0.78 | TDP1 (0.44) | TDP1CYP3A4TSHRALDH1A1HSD17B10 |
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-1173414-A1 | N-PROTECTED AMINES AND THEIR USE AS PRODRUGS | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 2002-01-23 | — | — | EP | disclosed |
| WO-2000064864-A1 | N-PROTECTED AMINES AND THEIR USE AS PRODRUGS | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 2000-11-02 | — | — | WO | disclosed |