Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | APEX1 | P27695 | 1/20 | 0.51 |
| ▸ | VNN1 | O95497 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12808989 | 0.85 | TDP1 (0.47) | TAAR1TDP1POLBAPEX1VNN1 | |
| SCHEMBL3615925 | 0.84 | TAAR1 (0.61) | TAAR1TDP1POLBAPEX1SMN1; SMN2 | |
| SCHEMBL6701560 | 0.83 | TDP1 (0.53) | TDP1POLBAPEX1VNN1GAA | |
| SCHEMBL5954493 | 0.82 | L3MBTL1 (0.55) | VNN1GAACTBP2AOC3HTT | |
| Hydrochloric Acid SCHEMBL7241255 | 0.80 | TDP1 (0.53) | TAAR1TDP1POLBAPEX1GAA | |
| SCHEMBL8833730 | 0.79 | TDP1 (0.56) | TDP1POLBAPEX1VNN1GAA | |
| SCHEMBL526194 | 0.78 | GAA (0.57) | TDP1POLBAPEX1GAASMN1; SMN2 | |
| SCHEMBL12731522 | 0.77 | GAA (0.48) | TDP1POLBAPEX1VNN1GAA | |
| SCHEMBL28154639 | 0.76 | TAAR1 (0.48) | TAAR1TDP1POLBAPEX1VNN1 | |
| SCHEMBL7038529 | 0.76 | GAA (0.47) | TDP1POLBAPEX1VNN1GAA |
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-1173431-B1 | METHOD FOR THE PREPARATION OF CITALOPRAM | LUNDBECK & CO AS H (DK) | 2003-04-16 | — | — | EP | claimed |