Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 11/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 11/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 11/20 | 0.44 |
| ▸ | PRKDC | P78527 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PDE5A | O76074 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.44 |
| ▸ | TACR2 | P21452 | 1/20 | 0.44 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17382980 | 0.87 | CYP1A1 (0.45) | CYP1A1CYP1A2CYP1B1PRKDCCYP3A4 | |
| SCHEMBL18655627 | 0.87 | CYP1A1 (0.43) | CYP1A1CYP1A2CYP1B1PRKDCCYP3A4 | |
| SCHEMBL17703163 | 0.86 | GABRP (0.49) | CYP1A2PRKDCCYP3A4TSHRCYP2C19 | |
| SCHEMBL17382979 | 0.85 | ARSA (0.42) | CYP1A1CYP1A2CYP1B1PRKDCCYP3A4 | |
| SCHEMBL31534638 | 0.85 | ARSA (0.42) | CYP1A1CYP1A2CYP1B1PRKDCCYP3A4 | |
| SCHEMBL25905354 | 0.85 | MAOB (0.48) | CYP1A1CYP1A2CYP1B1PRKDCCYP3A4 | |
| SCHEMBL17382982 | 0.84 | ARSA (0.41) | CYP1A1CYP1A2CYP1B1PRKDCCYP3A4 | |
| SCHEMBL28178526 | 0.83 | MAOB (0.46) | CYP1A1CYP1A2CYP3A4TSHRCYP2C19 | |
| SCHEMBL30760715 | 0.82 | PRKDC (0.47) | CYP1A1CYP1A2CYP1B1PRKDCCYP3A4 | |
| SCHEMBL26117842 | 0.82 | PRKDC (0.47) | CYP1A1CYP1A2CYP1B1PRKDCCYP3A4 |
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-2020231197-A1 | ORGANIC ELECTRIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2020-11-19 | — | — | WO | disclosed |