Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.67 |
| ▸ | HRH1 | P35367 | 1/20 | 0.67 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.67 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | FPR1 | P21462 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | RECQL | P46063 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | TEK | Q02763 | 1/20 | 0.52 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11308034 | 0.99 | CYP2C19 (0.66) | CYP2C19HRH1SLC22A8LMNAALDH1A1 | |
| SCHEMBL11310816 | 0.95 | CYP2C19 (0.61) | CYP2C19HRH1SLC22A8LMNAALDH1A1 | |
| SCHEMBL11308190 | 0.91 | CYP2C19 (0.60) | CYP2C19HRH1SLC22A8LMNAALDH1A1 | |
| SCHEMBL11318402 | 0.89 | CYP2C19 (0.63) | CYP2C19HRH1SLC22A8LMNAALDH1A1 | |
| SCHEMBL11310972 | 0.88 | CYP2C19 (0.75) | CYP2C19HRH1SLC22A8LMNAALDH1A1 | |
| SCHEMBL11311099 | 0.88 | CYP2C19 (0.56) | CYP2C19HRH1SLC22A8LMNAALDH1A1 | |
| SCHEMBL11311420 | 0.88 | CYP2C19 (0.74) | CYP2C19HRH1SLC22A8LMNAALDH1A1 | |
| SCHEMBL11309829 | 0.87 | CYP2C19 (0.71) | CYP2C19HRH1SLC22A8LMNAALDH1A1 | |
| SCHEMBL11309232 | 0.86 | CYP2C19 (0.55) | CYP2C19HRH1SLC22A8LMNAALDH1A1 | |
| SCHEMBL11313185 | 0.86 | CYP2C19 (0.59) | CYP2C19HRH1SLC22A8LMNAALDH1A1 |
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-4304717-A | Process for the preparation of reactive penicillanic acid and cephalosporanic acid derivatives | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT (HU) | 1981-12-08 | — | — | US | claimed |