Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL28952733 | 0.82 | KDM4E (0.31) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL27983009 | 0.69 | — | — | |
| SCHEMBL28038999 | 0.69 | NR3C1 (0.39) | KDM4E | |
| SCHEMBL27551544 | 0.69 | KDM4E (0.36) | KDM4EALDH1A1GAAHPGD | |
| SCHEMBL27542377 | 0.68 | HCAR2 (0.35) | HPGD | |
| SCHEMBL27491895 | 0.68 | DAO (0.43) | — | |
| SCHEMBL27759818 | 0.68 | HRH4 (0.38) | ALDH1A1 | |
| SCHEMBL28815738 | 0.67 | HMBS (0.36) | — | |
| SCHEMBL27785566 | 0.66 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL27734320 | 0.66 | GABRR1 (0.30) | — |
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-104755459-A | Fluoromethyl-substituted pyrrolecarboxamides | GRUENENTHAL CHEMIE | 2015-07-01 | — | — | CN | disclosed |