Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1644520 | 1.00 | TDP1 (0.40) | TDP1HSD17B10CYP3A4ALDH1A1HPGD | |
| SCHEMBL806315 | 0.97 | ALDH1A1 (0.46) | TDP1HSD17B10CYP3A4ALDH1A1HPGD | |
| SCHEMBL12856564 | 0.95 | ACHE (0.38) | TDP1HSD17B10CYP3A4ALDH1A1HPGD | |
| SCHEMBL1702512 | 0.95 | SIGMAR1 (0.38) | TDP1HSD17B10CYP3A4ALDH1A1HPGD | |
| SCHEMBL9427757 | 0.95 | ALDH1A1 (0.44) | TDP1HSD17B10CYP3A4ALDH1A1HPGD | |
| SCHEMBL25069433 | 0.95 | SIGMAR1 (0.38) | TDP1HSD17B10CYP3A4ALDH1A1HPGD | |
| SCHEMBL26221657 | 0.94 | TDP1 (0.36) | TDP1HSD17B10CYP3A4ALDH1A1HPGD | |
| SCHEMBL13321052 | 0.94 | TDP1 (0.36) | TDP1HSD17B10CYP3A4ALDH1A1HPGD | |
| SCHEMBL2700479 | 0.92 | ALDH1A1 (0.42) | TDP1HSD17B10CYP3A4ALDH1A1HPGD | |
| SCHEMBL22253650 | 0.92 | CYP1A2 (0.40) | TDP1HSD17B10CYP3A4ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-109970791-B | Indenotriphenylene derivative and organic electroluminescent device using the same | 机光科技股份有限公司 | 2022-07-22 | — | — | CN | disclosed |
| WO-2022034916-A1 | POLYCYCLIC AROMATIC COMPOUND | 学校法人関西学院 | 2022-02-17 | — | — | WO | disclosed |