Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29862055 | 0.74 | KDM4E (0.59) | CYP3A4TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL9482800 | 0.66 | ALDH1A1 (0.53) | CYP3A4TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL27634142 | 0.62 | MPO (0.42) | KDM4EALDH1A1HPGD | |
| SCHEMBL28184214 | 0.61 | CYP1A1 (0.37) | CYP3A4TSHRALDH1A1HPGD | |
| SCHEMBL10880428 | 0.61 | CYP3A4 (0.39) | CYP3A4TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL26210839 | 0.59 | CYP3A4 (0.47) | CYP3A4TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL5051603 | 0.58 | ALDH1A1 (0.53) | CYP3A4TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL8760169 | 0.58 | — | — | |
| SCHEMBL4850135 | 0.56 | TSHR (0.64) | CYP3A4TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL30001721 | 0.56 | TSHR (0.94) | CYP3A4TSHRKDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5322794-A | Fluorescent phospholipid analogs and fatty acid derivatives | DAVENPORT LESLEY | 1994-06-21 | — | — | US | disclosed |