Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 11/20 | 0.50 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7325790 | 0.83 | ALDH1A1 (0.43) | PARP1KDM4EALDH1A1HSD17B10MAPT | |
| SCHEMBL7426602 | 0.73 | ALDH1A1 (0.40) | KDM4EALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL10816016 | 0.72 | BCL2L1 (0.42) | KDM4EALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL10816476 | 0.72 | KDM4E (0.41) | KDM4EALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL8126957 | 0.69 | AURKA (0.43) | PARP1AURKAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL8026041 | 0.69 | CA2 (0.39) | LMNAMAPK1 | |
| SCHEMBL23720947 | 0.68 | HTR1A (0.31) | ALDH1A1 | |
| SCHEMBL13972198 | 0.68 | KDM1A (0.30) | — | |
| SCHEMBL31292138 | 0.68 | TRPA1 (0.57) | PARP1AURKAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL8290712 | 0.68 | MEN1 (0.38) | KDM4EALDH1A1MAPTHPGDTSHR |
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-105431433-B | Pesticidally active bicyclic or tricyclic heterocycles with sulfur-containing substituents | 先正达参股股份有限公司 | 2018-04-06 | — | — | CN | disclosed |
| CN-107652292-A | There are two rings or tricyclic heterocyclic with sulfur-bearing substituent for killing harmful organism activity | 先正达参股股份有限公司 | 2018-02-02 | — | — | CN | disclosed |