Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 11/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 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 | |
|---|---|---|---|---|
| SCHEMBL15495194 | 0.94 | POLB (0.40) | POLBAPEX1HTTTDP1ELANE | |
| SCHEMBL21663329 | 0.90 | POLB (0.37) | POLBAPEX1HTTTDP1ELANE | |
| SCHEMBL19157295 | 0.90 | POLB (0.37) | POLBAPEX1HTTTDP1ELANE | |
| SCHEMBL22537030 | 0.88 | HTT (0.38) | POLBAPEX1HTTTDP1ELANE | |
| SCHEMBL19497305 | 0.87 | POLB (0.34) | POLBAPEX1HTTTDP1ELANE | |
| SCHEMBL21841985 | 0.87 | POLB (0.34) | POLBAPEX1HTTTDP1ELANE | |
| SCHEMBL18473137 | 0.87 | POLB (0.34) | POLBAPEX1HTTTDP1ELANE | |
| SCHEMBL21559762 | 0.87 | POLB (0.35) | POLBAPEX1HTTTDP1ELANE | |
| SCHEMBL22537031 | 0.87 | POLB (0.35) | POLBAPEX1HTTTDP1ELANE | |
| SCHEMBL22383795 | 0.85 | TDP1 (0.39) | POLBAPEX1HTTTDP1ELANE |
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 |
|---|---|---|---|---|---|---|---|
| EP-2993216-B1 | COMPOUNDS AND LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2017-07-26 | — | — | EP | disclosed |