Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGAV | P06756 | 1/20 | 0.35 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1457933 | 0.80 | CYP19A1 (0.48) | SLC6A2SLC6A3CHRM2HTR1AADRA2A | |
| SCHEMBL12384507 | 0.79 | SLC6A2 (0.39) | SLC6A2SLC6A3CYP19A1ITGB3ITGAV | |
| SCHEMBL12422721 | 0.74 | CYP19A1 (0.36) | SLC6A2SLC6A3HRH3CYP19A1ITGB3 | |
| SCHEMBL4566612 | 0.63 | CYP19A1 (0.45) | SLC6A2SLC6A3CYP19A1HDAC1HDAC8 | |
| SCHEMBL1650349 | 0.63 | CA12 (0.49) | SLC6A2SLC6A3CYP19A1HDAC1HDAC8 | |
| SCHEMBL28853829 | 0.63 | PTGS2 (0.53) | CYP19A1HDAC1HDAC8 | |
| SCHEMBL9269708 | 0.63 | HDAC1 (0.51) | CYP19A1HDAC1HDAC8FAAHMAOB | |
| SCHEMBL12384488 | 0.63 | HDAC1 (0.57) | SLC6A2SLC6A3CYP19A1HDAC1HDAC8 | |
| SCHEMBL6099420 | 0.62 | NPC1 (0.55) | SLC6A2SLC6A3CYP19A1HDAC1HDAC8 | |
| SCHEMBL14207475 | 0.61 | CYP19A1 (0.45) | SLC6A2SLC6A3HTR1AHTR1BCYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8633239-B2 | Process for the preparation of eletriptan | BIOPHORE INDIA PHARMACEUTICALS PRIVATE LIMITED (IN) | 2014-01-21 | — | — | US | disclosed |