Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
| ▸ | HEXA | P06865 | 4/20 | 0.51 |
| ▸ | HEXB | P07686 | 4/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.50 |
| ▸ | FEN1 | P39748 | 1/20 | 0.50 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.49 |
| ▸ | HPGD | P15428 | 6/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL945778 | 0.85 | GAA (0.69) | TDP1GAAKDM4EALDH1A1HPGD | |
| SCHEMBL13707191 | 0.84 | TDP1 (0.73) | TDP1HEXAHEXBGAANPSR1 | |
| SCHEMBL2239815 | 0.78 | TDP1 (0.65) | TDP1HEXAHEXBGAANPSR1 | |
| SCHEMBL27566789 | 0.78 | TDP1 (0.88) | TDP1HEXAHEXBGAAERCC1 | |
| SCHEMBL28901731 | 0.77 | ERCC1 (0.61) | TDP1HEXAHEXBNPSR1ERCC1 | |
| SCHEMBL12451348 | 0.77 | GAA (0.62) | TDP1GAAALDH1A1MEN1KMT2A | |
| SCHEMBL8677467 | 0.77 | ALDH1A1 (0.73) | TDP1HEXAHEXBGAANPSR1 | |
| SCHEMBL20547085 | 0.76 | GAA (0.61) | TDP1GAAALDH1A1MEN1KMT2A | |
| SCHEMBL19999241 | 0.76 | ALDH1A1 (0.60) | TDP1HEXAHEXBNPSR1ERCC1 | |
| SCHEMBL28432135 | 0.75 | GAA (0.65) | TDP1GAAALDH1A1MEN1KMT2A |
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-0722942-A1 | Indole piperidine derivatives | MERCK PATENT GmbH (DE) | 1996-07-24 | — | — | EP | disclosed |