Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | IDO1 | P14902 | 11/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | SLC11A2 | P49281 | 2/20 | 0.50 |
| ▸ | NOS1 | P29475 | 2/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3684767 | 0.92 | HTT (0.59) | HTTHPGDIDO1TAAR1LMNA | |
| Bromide SCHEMBL4018130 | 0.90 | HTT (0.57) | HTTHPGDIDO1TAAR1LMNA | |
| SCHEMBL3690551 | 0.82 | HTT (0.65) | HTTHPGDIDO1TAAR1LMNA | |
| SCHEMBL3689189 | 0.82 | HTT (0.53) | HTTHPGDIDO1TAAR1LMNA | |
| SCHEMBL3694709 | 0.82 | HTT (0.53) | HTTHPGDIDO1TAAR1LMNA | |
| Bromide SCHEMBL4445136 | 0.81 | HTT (0.62) | HTTHPGDIDO1TAAR1LMNA | |
| Bromide SCHEMBL4015521 | 0.81 | HTT (0.51) | HTTHPGDIDO1TAAR1LMNA | |
| Bromide SCHEMBL4017471 | 0.81 | HTT (0.51) | HTTHPGDIDO1TAAR1LMNA | |
| SCHEMBL3679465 | 0.77 | IDO1 (0.67) | HTTHPGDIDO1TAAR1LMNA | |
| SCHEMBL14089893 | 0.76 | IDO1 (0.53) | HTTHPGDIDO1TAAR1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008109840-A1 | TRICYCLIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS | XENON PHARMACEUTICALS INC. (CA) | 2008-09-12 | — | — | WO | disclosed |