Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MGAM | O43451 | 4/20 | 0.41 |
| ▸ | SI | P14410 | 4/20 | 0.41 |
| ▸ | MGAM2 | Q2M2H8 | 4/20 | 0.41 |
| ▸ | CTSV | O60911 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17828553 | 0.94 | CTSV (0.46) | CYP1A2CYP2C19KDM4EALDH1A1MAPT | |
| SCHEMBL17828550 | 0.80 | ABL1 (0.46) | KDM4EALDH1A1MAPTHPGDTP53 | |
| SCHEMBL14600342 | 0.77 | PDK2 (0.44) | PDE10AGAACYP1A2CYP2C19KDM4E | |
| SCHEMBL5556584 | 0.76 | CYP1A2 (0.47) | PDE10AGAACYP1A2CYP2C19KDM4E | |
| SCHEMBL14600408 | 0.76 | PDK2 (0.43) | PDE10AGAACYP1A2CYP2C19KDM4E | |
| SCHEMBL14600417 | 0.76 | PDK2 (0.43) | PDE10AGAACYP1A2CYP2C19KDM4E | |
| SCHEMBL14600347 | 0.75 | PDK2 (0.43) | PDE10AGAACYP1A2CYP2C19KDM4E | |
| SCHEMBL14600484 | 0.75 | PDK2 (0.43) | PDE10AGAACYP1A2CYP2C19KDM4E | |
| SCHEMBL134695 | 0.75 | ACHE (0.47) | — | |
| SCHEMBL14600390 | 0.74 | PDK2 (0.47) | PDE10AGAACYP1A2CYP2C19KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-9997717-B2 | Organic electroluminescence device and electronic device | IDEMITSU KOSAN CO., LTD. (JP) | 2018-06-12 | — | — | US | disclosed |
| US-20160172601-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO., LTD. (JP) | 2016-06-16 | — | — | US | disclosed |