Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | PNMT | P11086 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10999631 | 0.83 | TSHR (0.46) | TSHRNOTUMCYP3A4MAPK1LMNA | |
| SCHEMBL7930064 | 0.81 | TSHR (0.44) | TSHRNOTUMCYP3A4MAPK1LMNA | |
| SCHEMBL10493705 | 0.79 | TSHR (0.34) | TSHRNOTUMCYP3A4MAPK1LMNA | |
| SCHEMBL10974022 | 0.76 | NOTUM (0.32) | TSHRNOTUM | |
| SCHEMBL7932263 | 0.75 | CYP1A2 (0.47) | TSHRCYP3A4MAPK1LMNACYP2A6 | |
| SCHEMBL27817597 | 0.74 | NOTUM (0.67) | NOTUMCYP1A2 | |
| SCHEMBL9889139 | 0.74 | NOTUM (0.38) | NOTUMCYP3A4MAPK1CYP2A6TDP1 | |
| SCHEMBL27779481 | 0.73 | CYP3A4 (0.50) | TSHRCYP3A4MAPK1LMNATDP1 | |
| SCHEMBL7803577 | 0.71 | TDP1 (0.62) | TSHRCYP3A4MAPK1LMNATDP1 | |
| SCHEMBL29368277 | 0.69 | CYP3A4 (0.62) | TSHRNOTUMCYP3A4MAPK1LMNA |
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-113582807-A | Method for synthesizing 2, 6-dichlorobenzyl chloride | 江苏超跃化学有限公司 | 2021-11-02 | — | — | CN | disclosed |
| CN-113582807-A | Method for synthesizing 2, 6-dichlorobenzyl chloride | 江苏超跃化学有限公司 | 2021-11-02 | — | — | CN | disclosed |