Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5805498 | 0.82 | TDP1 (0.52) | TDP1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL9622333 | 0.78 | TDP1 (0.59) | TDP1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL9622811 | 0.78 | TDP1 (0.59) | TDP1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL9622329 | 0.78 | TDP1 (0.59) | TDP1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL6905785 | 0.76 | TSHR (0.42) | TDP1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL13347012 | 0.76 | TDP1 (0.50) | TDP1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL271913 | 0.74 | ESR1 (0.37) | ALDH1A1HPGDTSHR | |
| SCHEMBL680098 | 0.74 | TDP1 (0.54) | TDP1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL10431545 | 0.74 | TDP1 (0.54) | TDP1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL1482484 | 0.73 | TDP1 (0.59) | TDP1ALDH1A1HPGDALOX15ALOX12 |
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-112387313-B | Tridentate phenanthroline manganese catalyst and application thereof in synthesis of organic silicon/boron compound | 中山大学 | 2022-08-16 | — | — | CN | disclosed |
| CN-112387313-A | Tridentate phenanthroline manganese catalyst and application thereof in synthesis of organic silicon/boron compound | 中山大学 | 2021-02-23 | — | — | CN | disclosed |