Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | BCR | P11274 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL4778866 | 0.80 | CHRNA7 (0.42) | GLACHRNA7NPSR1MEN1ALDH1A1 | |
| SCHEMBL4777615 | 0.75 | CHRNA7 (0.42) | CHRNA7NPSR1MEN1ALDH1A1LMNA | |
| SCHEMBL19798359 | 0.72 | CHRNA7 (0.67) | GLACHRNA7MEN1ALDH1A1LMNA | |
| SCHEMBL6287216 | 0.71 | HTT (0.50) | CHRNA7MEN1ALDH1A1LMNAHTT | |
| SCHEMBL19808409 | 0.69 | CHRNA7 (0.74) | CHRNA7TP53 | |
| SCHEMBL15694897 | 0.68 | HPGD (0.52) | GLACHRNA7NPSR1MEN1ALDH1A1 | |
| SCHEMBL17052682 | 0.68 | HPGD (0.52) | GLACHRNA7NPSR1MEN1ALDH1A1 | |
| SCHEMBL4778476 | 0.67 | TP53 (0.43) | GLACHRNA7NPSR1MEN1ALDH1A1 | |
| SCHEMBL4776177 | 0.65 | CACNA2D1 (0.45) | CHRNA7PTGS2PTGS1CYP1A2CYP3A4 | |
| SCHEMBL12980511 | 0.65 | HPGD (0.52) | CHRNA7NPSR1ALDH1A1HPGDHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1889617-A1 | Triphenyl modified 5-membered heterocycles and their use as anticancer and antiflammatory agents | Freie Universität Berlin (DE) | 2008-02-20 | — | — | EP | claimed |
| EP-1889617-A1 | Triphenyl modified 5-membered heterocycles and their use as anticancer and antiflammatory agents | Freie Universität Berlin (DE) | 2008-02-20 | — | — | EP | disclosed |