Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.61 |
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| 1,4-Dichlorobenzene SCHEMBL27808925 | 0.88 | LMNA (0.67) | LMNACYP2A6IDO1SMN1; SMN2SLC6A2 | |
| Dodecane SCHEMBL28192320 | 0.83 | SMN1; SMN2 (0.56) | LMNACYP2A6SMN1; SMN2TSHRKDM4E | |
| Chlorobenzene SCHEMBL11508402 | 0.83 | TSHR (0.69) | LMNACYP2A6SMN1; SMN2DRD2TSHR | |
| 1,4-Dichlorobenzene SCHEMBL16107734 | 0.81 | LMNA (0.57) | LMNACYP2A6IDO1TAAR1TSHR | |
| 1,4-Dichlorobenzene SCHEMBL27654439 | 0.79 | LMNA (0.80) | LMNACYP2A6IDO1SLC6A2SLC6A3 | |
| Butane SCHEMBL9788851 | 0.79 | CES2 (0.76) | LMNASMN1; SMN2TSHRKDM4EALDH1A1 | |
| SCHEMBL91196 | 0.78 | KDM4E (0.62) | IDO1SMN1; SMN2TAAR1KDM4EALDH1A1 | |
| 1,4-Dichlorobenzene SCHEMBL11243685 | 0.78 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL5191 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL3791051 | 0.76 | KDM4E (0.60) | IDO1SMN1; SMN2TAAR1KDM4EALDH1A1 |
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-109415357-A | Condensed heterocyclic compounds or its esters with hydrazone group and salt, garderning pesticide and its application method containing the compound | 日本农药株式会社 | 2019-03-01 | — | — | CN | disclosed |