Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL17032002 | 0.91 | CYP17A1 (0.51) | CYP17A1CYP19A1GAALMNACYP1A2 | |
| SCHEMBL17024453 | 0.85 | CYP17A1 (0.46) | CYP17A1CYP19A1GAALMNACYP1A2 | |
| SCHEMBL25800828 | 0.84 | GAA (0.54) | CYP17A1CYP19A1GAALMNACYP2C19 | |
| SCHEMBL13418069 | 0.82 | CYP17A1 (0.52) | CYP17A1CYP19A1LMNASMN1; SMN2KMT2A | |
| SCHEMBL22314260 | 0.79 | PTPN7 (0.49) | CYP17A1CYP19A1LMNAKMT2AMEN1 | |
| SCHEMBL22314259 | 0.79 | PTPN7 (0.49) | CYP17A1CYP19A1LMNAKMT2AMEN1 | |
| SCHEMBL25595389 | 0.77 | CYP17A1 (0.35) | CYP17A1CYP19A1KMT2AMAPT | |
| SCHEMBL14428570 | 0.76 | CYP19A1 (0.46) | CYP17A1CYP19A1GAACYP1A2KMT2A | |
| SCHEMBL14428545 | 0.76 | CYP17A1 (0.49) | CYP17A1CYP19A1GAALMNACYP1A2 | |
| SCHEMBL16406573 | 0.76 | CYP17A1 (0.45) | CYP17A1CYP19A1GAALMNAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-20150241779-A1 | REAGENT FOR ENHANCING GENERATION OF CHEMICAL SPECIES | OSAKA UNIVERSITY (JP) | 2015-08-27 | — | — | US | disclosed |