Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5088264 | 1.00 | HCAR2 (0.36) | HCAR2ALDH1A1LMNAHSD17B10CYP2D6 | |
| SCHEMBL3886257 | 0.90 | ALDH1A1 (0.40) | HCAR2ALDH1A1LMNAHSD17B10CYP2D6 | |
| SCHEMBL3886255 | 0.90 | ALDH1A1 (0.40) | HCAR2ALDH1A1LMNAHSD17B10CYP2D6 | |
| SCHEMBL10897365 | 0.81 | ALDH1A1 (0.37) | HCAR2ALDH1A1LMNAHSD17B10CYP2D6 | |
| SCHEMBL10897356 | 0.81 | ALDH1A1 (0.37) | HCAR2ALDH1A1LMNAHSD17B10CYP2D6 | |
| SCHEMBL30831370 | 0.81 | ALDH1A1 (0.37) | HCAR2ALDH1A1LMNAHSD17B10CYP2D6 | |
| SCHEMBL1116688 | 0.80 | HCAR2 (0.36) | HCAR2ALDH1A1LMNAHSD17B10CYP2D6 | |
| SCHEMBL1116690 | 0.80 | HCAR2 (0.36) | HCAR2ALDH1A1LMNAHSD17B10CYP2D6 | |
| SCHEMBL6855084 | 0.78 | TP53 (0.40) | ALDH1A1 | |
| SCHEMBL7798712 | 0.77 | HCAR2 (0.34) | HCAR2ALDH1A1LMNAHSD17B10CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008062460-A2 | CRYSTALLINE FORMS OF PREGABALIN | CADILA HEALTHCARE LIMITED (IN) | 2008-05-29 | — | — | WO | claimed |
| WO-2008062460-A2 | CRYSTALLINE FORMS OF PREGABALIN | CADILA HEALTHCARE LIMITED (IN) | 2008-05-29 | — | — | WO | disclosed |