Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.43 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 3/20 | 0.41 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13235820 | 0.84 | ALDH1A1 (0.44) | ALDH1A1MAOBTAAR1PPARGPPARA | |
| SCHEMBL20322838 | 0.84 | KDM4E (0.51) | ALDH1A1PPARGPPARAKDM4ESLC1A2 | |
| SCHEMBL6443526 | 0.84 | KDM4E (0.51) | ALDH1A1PPARGPPARAKDM4ESLC1A2 | |
| SCHEMBL4672066 | 0.80 | ALDH1A1 (0.49) | ALDH1A1SCN9AMAOBPARP15PARP14 | |
| SCHEMBL363390 | 0.80 | PPARG (0.43) | ALDH1A1TAAR1PPARGPPARADPP4 | |
| SCHEMBL18511376 | 0.80 | ALDH1A1 (0.49) | ALDH1A1SCN9AMAOBPARP15PARP14 | |
| SCHEMBL20341737 | 0.79 | KMT2A (0.49) | ALDH1A1SCN9APPARGPPARAKDM4E | |
| SCHEMBL9160670 | 0.79 | IDO1 (0.43) | MAOBDPP4DPP7IDO1RIPK1 | |
| SCHEMBL17173869 | 0.79 | DPP4 (0.49) | ALDH1A1TAAR1PPARGPPARADPP4 | |
| SCHEMBL23347637 | 0.78 | ALDH1A1 (0.47) | ALDH1A1SCN9AMAOBPARP15PARP14 |
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-109715631-A | 6 inhibitor of TRAF | 德国亥姆霍兹慕尼黑中心健康与环境研究中心（有限公司） | 2019-05-03 | — | — | CN | claimed |