Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PREP | P48147 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4469459 | 0.74 | ALDH1A1 (0.42) | HPGDALDH1A1POLBHTTGAA | |
| SCHEMBL23929246 | 0.72 | ALDH1A1 (0.45) | HPGDALDH1A1POLBHTTGAA | |
| SCHEMBL28061202 | 0.70 | ALDH1A1 (0.38) | HPGDALDH1A1POLBHTTGAA | |
| SCHEMBL23727040 | 0.68 | HPGD (0.58) | HPGDALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL7705533 | 0.68 | CES2 (0.39) | HPGDALDH1A1GAAHSD11B1TSHR | |
| SCHEMBL428708 | 0.68 | — | — | |
| SCHEMBL31623264 | 0.68 | HSD11B1 (0.33) | HTTHSD11B1 | |
| SCHEMBL4592557 | 0.67 | HPGD (0.40) | HPGDDPP4ALDH1A1POLBHTT | |
| SCHEMBL17560432 | 0.67 | ALDH1A1 (0.39) | HPGDDPP4ALDH1A1POLBHTT | |
| SCHEMBL29999217 | 0.67 | ALDH1A1 (0.36) | HPGDALDH1A1POLBHTTGAA |
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-113166117-A | Heteroaromatic compounds as VANIN inhibitors | 勃林格殷格翰国际公司 | 2021-07-23 | — | — | CN | disclosed |