Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.75 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.75 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.67 |
| ▸ | NPC1 | O15118 | 1/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL21098369 | 0.86 | SMN1; SMN2 (0.89) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB | |
| SCHEMBL10931952 | 0.86 | ALDH1A1 (0.75) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB | |
| SCHEMBL5257694 | 0.85 | SMN1; SMN2 (0.78) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB | |
| SCHEMBL12990109 | 0.83 | ALDH1A1 (0.74) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB | |
| SCHEMBL10924576 | 0.82 | ALDH1A1 (0.70) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB | |
| SCHEMBL10922996 | 0.81 | ALDH1A1 (0.72) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB | |
| SCHEMBL10919809 | 0.81 | ALDH1A1 (0.69) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB | |
| SCHEMBL10924053 | 0.81 | ALDH1A1 (0.69) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB | |
| SCHEMBL4484066 | 0.81 | SMN1; SMN2 (0.80) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB | |
| SCHEMBL13211944 | 0.80 | SMN1; SMN2 (0.78) | ALDH1A1CYP19A1SMN1; SMN2NPC1POLB |
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-2074120-B1 | TROPANE COMPOUNDS | EXELIXIS INC (US) | 2010-03-03 | — | — | EP | disclosed |