Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.33 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.33 |
| ▸ | FKBP4 | Q02790 | 1/20 | 0.33 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7177956 | 0.85 | CNR1 (0.38) | CYP1A2CYP2C19HSD17B10ALDH1A1CNR1 | |
| SCHEMBL7176742 | 0.85 | CNR1 (0.38) | CYP1A2CYP2C19HSD17B10ALDH1A1CNR1 | |
| SCHEMBL8463579 | 0.83 | MAPT (0.35) | ALDH1A1LMNATP53 | |
| SCHEMBL7173479 | 0.78 | GFER (0.41) | CYP1A2CYP2C19GFERLMNAFKBP1A | |
| SCHEMBL7173487 | 0.78 | GFER (0.41) | CYP1A2CYP2C19GFERLMNAFKBP1A | |
| SCHEMBL1492154 | 0.75 | LPAR1 (0.39) | ALDH1A1LMNAFKBP1A | |
| SCHEMBL6472382 | 0.75 | LPAR1 (0.39) | ALDH1A1LMNAFKBP1A | |
| SCHEMBL7181772 | 0.74 | F10 (0.38) | ALDH1A1LMNATP53 | |
| SCHEMBL7176769 | 0.74 | F10 (0.38) | ALDH1A1LMNATP53 | |
| SCHEMBL8780679 | 0.73 | SLC2A1 (0.39) | ALDH1A1LMNA |
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-0946190-A1 | METHODS AND COMPOSITIONS FOR STIMULATING NEURITE GROWTH USING COMPOUNDS WITH AFFINITY FOR FKBP12 IN COMBINATION WITH NEUROTROPHIC FACTORS | Vertex Pharmaceuticals Incorporated (US) | 1999-10-06 | — | — | EP | claimed |
| WO-1998020891-A1 | METHODS AND COMPOSITIONS FOR STIMULATING NEURITE GROWTH USING COMPOUNDS WITH AFFINITY FOR FKBP12 IN COMBINATION WITH NEUROTROPHIC FACTORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 1998-05-22 | — | — | WO | claimed |