Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.57 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.57 |
| ▸ | CFD | P00746 | 1/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | AKR1C4 | P17516 | 5/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ERN1 | O75460 | 1/20 | 0.50 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.49 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30451054 | 1.00 | EPHX2 (0.57) | EPHX2NR1H4CFDHDAC1KDM4E | |
| SCHEMBL29032787 | 0.88 | CFD (0.71) | EPHX2NR1H4CFDHDAC1ALDH1A1 | |
| SCHEMBL30450570 | 0.88 | CFD (0.71) | EPHX2NR1H4CFDHDAC1ALDH1A1 | |
| SCHEMBL1927512 | 0.85 | EPHX2 (0.77) | EPHX2NR1H4CFDHDAC1AKR1C4 | |
| SCHEMBL29032748 | 0.85 | LMNA (0.52) | EPHX2NR1H4CFDHDAC1KDM4E | |
| SCHEMBL7610793 | 0.83 | CA1 (0.56) | EPHX2NR1H4CFDHDAC1KDM4E | |
| SCHEMBL29032741 | 0.81 | CFD (0.52) | EPHX2NR1H4CFDHDAC1KDM4E | |
| SCHEMBL31324979 | 0.79 | CYP2C9 (0.57) | EPHX2NR1H4CFDHDAC1KDM4E | |
| SCHEMBL29332482 | 0.79 | TSHR (0.64) | EPHX2NR1H4KDM4EALDH1A1HPGD | |
| SCHEMBL30450620 | 0.78 | CFD (0.64) | EPHX2NR1H4CFDHDAC1ALDH1A1 |
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-116253686-B | Aminobenzimidazole benzamide derivative and application thereof | 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) | 2023-11-17 | — | — | CN | disclosed |
| CN-116253686-A | Aminobenzimidazole benzamide derivative and application thereof | 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) | 2023-06-13 | — | — | CN | disclosed |