Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | USP7 | Q93009 | 1/20 | 0.38 |
| ▸ | USP47 | Q96K76 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL6886786 | 0.84 | TDP1 (0.48) | TDP1ALDH1A1LMNAHPGDTSHR | |
| SCHEMBL6556681 | 0.80 | TDP1 (0.44) | TDP1ALDH1A1LMNATSHRSMN1; SMN2 | |
| SCHEMBL18924893 | 0.79 | CYP2C19 (0.44) | TDP1ALDH1A1LMNAHPGDTSHR | |
| SCHEMBL4728834 | 0.77 | HPGD (0.46) | TDP1ALDH1A1LMNAHPGDTSHR | |
| SCHEMBL19223460 | 0.76 | CYP1A2 (0.42) | TDP1ALDH1A1LMNAHPGDTSHR | |
| SCHEMBL18286925 | 0.74 | TDP1 (0.58) | TDP1ALDH1A1TSHRSMN1; SMN2GPR35 | |
| SCHEMBL30559692 | 0.74 | ALDH1A1 (0.54) | TDP1ALDH1A1LMNAHPGDTSHR | |
| SCHEMBL6556643 | 0.74 | ALDH1A1 (0.54) | TDP1ALDH1A1LMNAHPGDTSHR | |
| SCHEMBL13983075 | 0.71 | HPGD (0.44) | TDP1ALDH1A1LMNAHPGDTSHR | |
| SCHEMBL700473 | 0.71 | TDP1 (0.72) | TDP1ALDH1A1LMNAHPGDTSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0976725-B1 | Process for the continuous preparation of amino-halogenophenyl alkyl thioethers | BAYER CHEMICALS AG (DE) | 2004-03-03 | — | — | EP | claimed |