Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 6/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | USP5 | P45974 | 3/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20031544 | 0.83 | NR1H4 (0.48) | NR1H4MAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL20031474 | 0.83 | NR1H4 (0.48) | NR1H4MAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL17859463 | 0.75 | KMT2A (0.40) | NR1H4MAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL26047391 | 0.68 | NR1H4 (0.48) | NR1H4MAPT | |
| SCHEMBL21098158 | 0.66 | SMN1; SMN2 (0.39) | NR1H4MAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL26045428 | 0.63 | NR1H4 (0.51) | NR1H4 | |
| SCHEMBL19123541 | 0.62 | SMN1; SMN2 (0.70) | NR1H4MAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL22790024 | 0.62 | SMN1; SMN2 (0.47) | NR1H4MAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL23697980 | 0.60 | NR1H4 (0.50) | NR1H4 | |
| SCHEMBL20952011 | 0.60 | SMN1; SMN2 (0.44) | MAPTSMN1; SMN2RAB9ANPC1ALDH1A1 |
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-2018059314-A1 | AZABICYCLE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2018-04-05 | — | — | WO | disclosed |