Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | HPGDS | O60760 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 2/20 | 0.42 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10038535 | 0.91 | HPGDS (0.50) | CYP2A6HPGDSPIM1NPC1TP53 | |
| SCHEMBL10018839 | 0.87 | CYP2A6 (0.46) | CYP2A6HPGDSMAPTCNR2CYP19A1 | |
| SCHEMBL18016432 | 0.84 | HPGDS (0.47) | CYP2A6HPGDSNPC1TP53PKM | |
| SCHEMBL21396886 | 0.82 | CYP2A6 (0.54) | CYP2A6CYP3A4PIM1PIM2NPC1 | |
| SCHEMBL6254179 | 0.82 | HPGDS (0.45) | CYP3A4HPGDSCYP11B1CYP11B2 | |
| SCHEMBL3509967 | 0.82 | CYP2A6 (0.85) | CYP2A6CYP3A4HPGDSPIM1PIM2 | |
| SCHEMBL7116118 | 0.82 | CYP2A6 (0.50) | CYP2A6CYP3A4NPC1TP53RAB9A | |
| SCHEMBL16189464 | 0.81 | CYP3A4 (0.40) | CYP2A6CYP3A4HPGDSNPC1PKM | |
| SCHEMBL12114839 | 0.80 | HPGDS (0.48) | CYP2A6HPGDSPIM1NPC1TP53 | |
| SCHEMBL6256350 | 0.79 | CYP2A6 (0.47) | CYP2A6CYP3A4NPC1TP53RAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9944629-B2 | Material for organic electroluminescent element, organic electroluminescent element, illumination device, and display device | Konica Minolta, Inc. (JP) | 2018-04-17 | — | — | US | disclosed |
| US-9944629-B2 | Material for organic electroluminescent element, organic electroluminescent element, illumination device, and display device | Konica Minolta, Inc. (JP) | 2018-04-17 | — | — | US | disclosed |
| US-20150322337-A1 | MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, AND DISPLAY DEVICE | Konica Minolta, Inc. (JP) | 2015-11-12 | — | — | US | disclosed |
| US-20150322337-A1 | MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, AND DISPLAY DEVICE | Konica Minolta, Inc. (JP) | 2015-11-12 | — | — | US | disclosed |