Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 9/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 9/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 9/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25733707 | 0.92 | KDM4E (0.43) | CYP1A1CYP1A2CYP1B1IKBKBAHR | |
| SCHEMBL25645295 | 0.90 | AHR (0.38) | CYP1A1CYP1A2CYP1B1AHRKDM4E | |
| SCHEMBL25276994 | 0.87 | CYP1A1 (0.44) | CYP1A1CYP1A2CYP1B1IKBKBAHR | |
| SCHEMBL25281652 | 0.82 | KDM4E (0.43) | CYP1A1CYP1A2CYP1B1AHRKDM4E | |
| SCHEMBL31364126 | 0.82 | KDM4E (0.46) | CYP1A1CYP1A2CYP1B1AHRKDM4E | |
| SCHEMBL22174350 | 0.82 | KDM4E (0.46) | CYP1A1CYP1A2CYP1B1AHRKDM4E | |
| SCHEMBL25733726 | 0.81 | CYP1A1 (0.48) | CYP1A1CYP1A2CYP1B1AHRKDM4E | |
| SCHEMBL24519124 | 0.81 | AHR (0.51) | CYP1A1CYP1A2CYP1B1AHRHTT | |
| SCHEMBL19081781 | 0.81 | CYP1A1 (0.40) | CYP1A1CYP1A2CYP1B1IKBKBAHR | |
| SCHEMBL19081803 | 0.81 | CYP1A1 (0.43) | CYP1A1CYP1A2CYP1B1IKBKBKDM4E |
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-2023113333-A1 | COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE | 삼성에스디아이 주식회사 | 2023-06-22 | — | — | WO | disclosed |