Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 3/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP12 | P39900 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL29037153 | 0.80 | GRM5 (0.42) | NQO1PARP10IDO1MMP1MMP2 | |
| SCHEMBL4438859 | 0.80 | IDO1 (0.44) | IDO1MMP1MMP2MMP9MMP12 | |
| SCHEMBL25384621 | 0.78 | RAB9A (0.36) | MMP1MMP2MMP9MMP12MAPT | |
| SCHEMBL28954128 | 0.76 | IDO1 (0.42) | IDO1MAPTNPSR1 | |
| SCHEMBL31197259 | 0.76 | IDO1 (0.36) | IDO1 | |
| SCHEMBL114463 | 0.75 | PARP10 (0.57) | PARP10IDO1MMP1MMP2MMP9 | |
| SCHEMBL23072809 | 0.73 | MEN1 (0.35) | IDO1MAPTKMT2ANPSR1 | |
| SCHEMBL25383151 | 0.72 | IDO1 (0.31) | IDO1 | |
| SCHEMBL17080518 | 0.71 | CYP3A4 (0.54) | PARP10IDO1KMT2A | |
| SCHEMBL15430107 | 0.70 | GABRA1 (0.39) | MAPTRAB9AKMT2A |
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-108137509-B | Pyrrole, oxadiazole, triazole or tetrazole derivatives suitable for controlling arthropods | 拜耳作物科学股份公司 | 2021-03-19 | — | — | CN | disclosed |