Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 2/20 | 0.45 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.41 |
| ▸ | TOP2A | P11388 | 1/20 | 0.38 |
| ▸ | PRKCI | P41743 | 1/20 | 0.37 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 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 | |
|---|---|---|---|---|
| SCHEMBL16484347 | 0.82 | LMNA (0.47) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL23309028 | 0.81 | TUBB4A (0.41) | CYP11B1CYP11B2CYP17A1CYP19A1AKT1 | |
| SCHEMBL15791593 | 0.79 | BIRC5 (0.37) | TDO2CYP11B1CYP11B2CYP19A1CYP1A2 | |
| SCHEMBL880868 | 0.79 | TDP1 (0.44) | CYP1A2CYP2C9HSD17B1CYP2C19HSD17B2 | |
| SCHEMBL23332358 | 0.78 | ALDH1A1 (0.40) | CYP11B1CYP11B2CYP17A1CYP19A1AKT1 | |
| SCHEMBL880851 | 0.77 | TDP1 (0.43) | CYP1A2CYP3A4CYP2D6CYP2C9HSD17B1 | |
| SCHEMBL19266358 | 0.77 | TDP1 (0.40) | AKT1CYP1A2CYP2C9HSD17B1CYP2C19 | |
| SCHEMBL19266843 | 0.77 | TDP1 (0.40) | AKT1CYP1A2CYP2C9HSD17B1CYP2C19 | |
| SCHEMBL20149428 | 0.77 | TDP1 (0.44) | CYP1A2CYP2D6CYP2C9CYP2C19KDM4E | |
| SCHEMBL24372691 | 0.77 | ALDH1A1 (0.37) | CYP11B1CYP11B2CYP17A1CYP19A1AKT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016116521-A1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC COMPONENTS | CYNORA GMBH (DE) | 2016-07-28 | — | — | WO | disclosed |