Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RAD52 | P43351 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | QPCT | Q16769 | 2/20 | 0.44 |
| ▸ | QPCTL | Q9NXS2 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| Benzimidazole SCHEMBL2334176 | 0.90 | PRKCI (0.50) | PRKCIKDM4EMAPTRAD52ALDH1A1 | |
| Benzimidazole SCHEMBL4371075 | 0.88 | KDM4E (0.51) | PRKCIKDM4EMAPTRAD52ALDH1A1 | |
| Benzimidazole SCHEMBL16583698 | 0.88 | PRKCI (0.46) | PRKCIKDM4EMAPTRAD52ALDH1A1 | |
| Benzimidazole SCHEMBL5070094 | 0.88 | KDM4E (0.51) | PRKCIKDM4EMAPTRAD52ALDH1A1 | |
| Benzimidazole SCHEMBL5404384 | 0.87 | PRKCI (0.52) | PRKCIKDM4EMAPTRAD52ALDH1A1 | |
| Benzimidazole SCHEMBL10931770 | 0.87 | SMN1; SMN2 (0.50) | PRKCIKDM4EMAPTRAD52ALDH1A1 | |
| Benzimidazole SCHEMBL461969 | 0.87 | SMN1; SMN2 (0.50) | PRKCIKDM4EMAPTRAD52ALDH1A1 | |
| Benzimidazole SCHEMBL29358377 | 0.87 | — | — | |
| Benzimidazole SCHEMBL29408372 | 0.87 | — | — | |
| Benzimidazole SCHEMBL6009 | 0.87 | — | — |
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-114685495-B | N-difluoromethyl diazacyclo selenourea compound with insecticidal, bacteriostatic, herbicidal and anticancer effects and preparation and application thereof | 华南农业大学 | 2023-08-04 | — | — | CN | disclosed |
| CN-114685495-A | N-difluoromethyl dinitrogen heterocyclic selenourea compounds with insecticidal, antibacterial, herbicidal and anticancer effects, and preparation and application thereof | 华南农业大学 | 2022-07-01 | — | — | CN | disclosed |