Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP2A13 | Q16696 | 3/20 | 0.41 |
| ▸ | MGLL | Q99685 | 2/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 2/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| 1,2-Dichlorobenzene SCHEMBL4473756 | 0.93 | LMNA (0.56) | LMNATSHRCYP2A13MGLLAKR1C3 | |
| 1,2-Dichlorobenzene SCHEMBL28449184 | 0.82 | LMNA (0.62) | LMNATSHRCYP2A13MGLLAKR1C3 | |
| 1,2-Dichlorobenzene SCHEMBL27256401 | 0.79 | TSHR (0.77) | LMNATSHRMGLLALDH1A1POLB | |
| Tetrahydrofuran SCHEMBL21177351 | 0.78 | CYP2A13 (0.48) | TSHRCYP2A13ALDH1A1POLBRAD51 | |
| Tetrahydrofuran SCHEMBL28235396 | 0.77 | CYP2A13 (0.39) | LMNATSHRCYP2A13MGLLAKR1C3 | |
| 1,2-Dichlorobenzene SCHEMBL28068670 | 0.77 | TSHR (0.56) | LMNATSHRCYP2A13MGLLALDH1A1 | |
| Chlorobenzene SCHEMBL7956389 | 0.75 | TSHR (0.58) | LMNATSHRCYP2A13MGLLALDH1A1 | |
| Tetrahydrofuran SCHEMBL28954345 | 0.74 | ALDH1A1 (0.46) | CYP2A13ALDH1A1POLBSMN1; SMN2RECQL | |
| Tetrahydrofuran SCHEMBL28594950 | 0.74 | HPGD (0.49) | TSHRALDH1A1POLBMAPTPKM | |
| Tetrahydrofuran SCHEMBL9684561 | 0.74 | CYP2A13 (0.53) | CYP2A13MGLLALDH1A1MAPTPKM |
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 |
|---|---|---|---|---|---|---|---|
| CN-106279082-A | Substituted furan chalcone derivant and preparation method thereof | 浙江大学 | 2017-01-04 | — | — | CN | disclosed |