Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.36 |
| ▸ | SCD | O00767 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28714797 | 1.00 | HTT (0.39) | HTTRAB9AF2ALDH1A1S1PR5 | |
| SCHEMBL28720246 | 0.87 | SMN1; SMN2 (0.39) | ALDH1A1S1PR5 | |
| SCHEMBL28720244 | 0.87 | SMN1; SMN2 (0.39) | ALDH1A1S1PR5 | |
| SCHEMBL28719052 | 0.81 | ACKR3 (0.35) | HTTALDH1A1POLB | |
| SCHEMBL18740496 | 0.77 | ALDH1A1 (0.41) | HTTRAB9AF2ALDH1A1POLB | |
| SCHEMBL18740497 | 0.77 | ALDH1A1 (0.41) | HTTRAB9AF2ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL18740594 | 0.76 | ALDH1A1 (0.41) | HTTRAB9AF2ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL18740595 | 0.76 | ALDH1A1 (0.41) | HTTRAB9AF2ALDH1A1POLB | |
| SCHEMBL18740556 | 0.75 | ALDH1A1 (0.41) | HTTRAB9AALDH1A1POLB | |
| SCHEMBL18740533 | 0.74 | HTT (0.41) | HTTALDH1A1POLB |
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-108368101-B | Selective NR2B antagonists | 百时美施贵宝公司 | 2022-03-15 | — | — | CN | disclosed |