Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.63 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28238186 | 0.85 | NPC1 (0.47) | CYP1A2NPC1MAPTSMN1; SMN2RAB9A | |
| SCHEMBL28239170 | 0.84 | CYP1A2 (0.44) | CYP1A2NPC1MAPTSMN1; SMN2RAB9A | |
| SCHEMBL28280836 | 0.84 | MEN1 (0.59) | CYP1A2NPC1MAPTSMN1; SMN2RAB9A | |
| SCHEMBL28239457 | 0.83 | POLB (0.55) | CYP1A2NPC1MAPTSMN1; SMN2RAB9A | |
| SCHEMBL28282172 | 0.81 | KMT2A (0.46) | CYP1A2NPC1MAPTSMN1; SMN2RAB9A | |
| SCHEMBL28282155 | 0.80 | KDM4E (0.46) | CYP1A2NPC1MAPTSMN1; SMN2RAB9A | |
| SCHEMBL28238300 | 0.75 | ATM (0.44) | CYP1A2NPC1MAPTSMN1; SMN2RAB9A | |
| SCHEMBL28863093 | 0.75 | KDM4E (0.45) | CYP1A2MAPTSMN1; SMN2KDM4ETDP1 | |
| SCHEMBL28239168 | 0.74 | MAPT (0.45) | CYP1A2NPC1MAPTSMN1; SMN2RAB9A | |
| SCHEMBL28280837 | 0.73 | PKM (0.60) | CYP1A2NPC1MAPTSMN1; SMN2RAB9A |
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-109438427-A | A kind of triazole schiff bases myricetin derivative, the preparation method and the usage of Sulfide-containing Hindered | 贵州大学 | 2019-03-08 | — | — | CN | disclosed |
| CN-108358896-A | A kind of compound and preparation method being used to prepare prevention crop pathogenic bacteria drug | 贵州大学 | 2018-08-03 | — | — | CN | disclosed |