Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | GBA1 | P04062 | 8/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9565312 | 0.83 | SMN1; SMN2 (0.46) | HSD17B10ALDH1A1SMN1; SMN2LMNATP53 | |
| SCHEMBL9565355 | 0.80 | ALDH1A1 (0.49) | HSD17B10ALDH1A1SMN1; SMN2LMNATP53 | |
| SCHEMBL7430157 | 0.80 | MAPK1 (0.42) | CYP2A6CYP3A4CYP2C19CYP2C9MAPK1 | |
| SCHEMBL9565317 | 0.70 | SMN1; SMN2 (0.49) | HSD17B10ALDH1A1SMN1; SMN2LMNATP53 | |
| SCHEMBL7333247 | 0.68 | IKBKB (0.41) | ALDH1A1SMN1; SMN2KDM4EMAPTHPGD | |
| SCHEMBL13830263 | 0.66 | ALDH1A1 (1.00) | HSD17B10ALDH1A1SMN1; SMN2LMNATP53 | |
| SCHEMBL29384483 | 0.66 | ALDH1A1 (1.00) | HSD17B10ALDH1A1SMN1; SMN2LMNATP53 | |
| SCHEMBL9565364 | 0.65 | ALDH1A1 (0.50) | HSD17B10ALDH1A1SMN1; SMN2LMNATP53 | |
| SCHEMBL19554680 | 0.64 | MKNK1 (0.47) | HSD17B10ALDH1A1SMN1; SMN2LMNATP53 | |
| SCHEMBL29779689 | 0.64 | MKNK1 (0.47) | HSD17B10ALDH1A1SMN1; SMN2LMNATP53 |
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-0543245-A1 | Renin inhibiting amino acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1993-05-26 | — | — | EP | disclosed |