Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 13/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 12/20 | 0.34 |
| ▸ | ESRRB | O95718 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESRRA | P11474 | 1/20 | 0.34 |
| ▸ | ESRRG | P62508 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28643152 | 0.85 | NR1H2 (0.38) | NR1H2GPR119NPC1LMNANR2F2 | |
| SCHEMBL19635047 | 0.85 | SMN1; SMN2 (0.47) | GPR119NPC1LMNANR2F2HTT | |
| SCHEMBL21802247 | 0.78 | MAPT (0.44) | NPC1LMNASMN1; SMN2 | |
| SCHEMBL29291172 | 0.74 | NR1H2 (0.53) | NR1H2GPR119LMNANR1H3 | |
| SCHEMBL19634868 | 0.72 | SMN1; SMN2 (0.47) | GPR119NPC1LMNANR2F2HTT | |
| SCHEMBL19615367 | 0.72 | MEN1 (0.44) | LMNAHTTSMN1; SMN2 | |
| SCHEMBL23251241 | 0.71 | SMN1; SMN2 (0.46) | GPR119NPC1LMNANR2F2HTT | |
| SCHEMBL19635767 | 0.70 | SMN1; SMN2 (0.45) | GPR119NPC1LMNANR2F2HTT | |
| SCHEMBL28956431 | 0.69 | NR1H2 (0.54) | NR1H2GPR119LMNAHTTNR1H3 | |
| SCHEMBL31180987 | 0.69 | GPR119 (0.59) | NR1H2GPR119NPC1NR1H3RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-109715632-B | Macrocyclic indole derivatives | 拜尔公开股份有限公司 | 2021-10-26 | — | — | CN | disclosed |