Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29352216 | 0.73 | TSHR (0.65) | TSHRCYP1A2CYP2A6HSD11B1ALDH1A1 | |
| SCHEMBL2951616 | 0.73 | TSHR (0.65) | TSHRCYP1A2CYP2A6HSD11B1ALDH1A1 | |
| SCHEMBL14134503 | 0.71 | CYP1A2 (0.48) | TSHRCYP1A2CYP2A6HSD11B1ALDH1A1 | |
| Lithium SCHEMBL30066819 | 0.71 | TSHR (0.62) | TSHRCYP1A2CYP2A6HSD11B1ALDH1A1 | |
| SCHEMBL28661847 | 0.70 | GPR3 (0.39) | TSHRALDH1A1MAPTHSD17B10TDP1 | |
| SCHEMBL1451563 | 0.69 | TSHR (0.60) | TSHRCYP1A2CYP2A6HSD11B1ALDH1A1 | |
| SCHEMBL30356330 | 0.68 | CYP1A2 (0.48) | TSHRCYP1A2CYP2A6HSD11B1ALDH1A1 | |
| SCHEMBL14134222 | 0.68 | CYP1A2 (0.48) | TSHRCYP1A2CYP2A6HSD11B1ALDH1A1 | |
| SCHEMBL21110937 | 0.67 | HTR2C (0.38) | CYP1A2ALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL14134412 | 0.67 | CYP2A6 (0.47) | TSHRCYP1A2CYP2A6HSD11B1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111410624-A | Asymmetric naphthalene-pyrrole hybrid diarylethene compound and application thereof | 江西科技师范大学 | 2020-07-14 | — | — | CN | claimed |
| CN-111410624-B | Asymmetric naphthalene-pyrrole hybrid diarylethene compound and application thereof | 江西科技师范大学 | 2022-05-06 | — | — | CN | disclosed |
| CN-111410624-A | Asymmetric naphthalene-pyrrole hybrid diarylethene compound and application thereof | 江西科技师范大学 | 2020-07-14 | — | — | CN | disclosed |