Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | PKM | P14618 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.57 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | SPR | P35270 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL20462830 | 0.84 | NOTUM (0.75) | NOTUMALDH1A1NPC1PKMCYP2C19 | |
| SCHEMBL5523654 | 0.84 | NOTUM (1.00) | NOTUMALDH1A1NPC1PKMCYP2C19 | |
| SCHEMBL10167044 | 0.84 | NOTUM (1.00) | NOTUMALDH1A1NPC1PKMCYP2C19 | |
| SCHEMBL2586534 | 0.84 | NOTUM (1.00) | NOTUMALDH1A1NPC1PKMCYP2C19 | |
| SCHEMBL8057268 | 0.83 | NOTUM (0.73) | NOTUMALDH1A1NPC1PKMCYP2C19 | |
| SCHEMBL14002986 | 0.82 | NOTUM (0.67) | NOTUMALDH1A1NPC1PKMCYP2C19 | |
| SCHEMBL8518559 | 0.82 | NOTUM (0.67) | NOTUMALDH1A1NPC1PKMCYP2C19 | |
| SCHEMBL10896924 | 0.82 | NOTUM (0.67) | NOTUMALDH1A1NPC1PKMCYP2C19 | |
| SCHEMBL18701768 | 0.80 | NOTUM (0.69) | NOTUMALDH1A1NPC1PKMCYP2C19 | |
| SCHEMBL18701769 | 0.80 | NOTUM (0.69) | NOTUMALDH1A1NPC1PKMCYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2493853-A1 | ORGANIC COMPOUNDS | Givaudan SA (CH) | 2012-09-05 | — | — | EP | disclosed |
| WO-2011051394-A1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2011-05-05 | — | — | WO | disclosed |