Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | PRNP | P04156 | 1/20 | 0.48 |
| ▸ | NAPRT | Q6XQN6 | 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 | |
|---|---|---|---|---|
| SCHEMBL9002107 | 0.90 | SMN1; SMN2 (0.53) | KDM4ESMN1; SMN2HTTL3MBTL1TRPV1 | |
| SCHEMBL25359886 | 0.81 | CYP17A1 (0.51) | KDM4ETDP1TRPV1 | |
| SCHEMBL10726628 | 0.81 | SMN1; SMN2 (0.67) | KDM4ETDP1SMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL2557875 | 0.80 | KDM4E (0.62) | KDM4ETDP1SMN1; SMN2L3MBTL1TRPV1 | |
| SCHEMBL14564497 | 0.80 | KDM4E (0.67) | KDM4ETDP1SMN1; SMN2L3MBTL1TRPV1 | |
| SCHEMBL912675 | 0.79 | KDM4E (0.77) | KDM4ETDP1SMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL31586013 | 0.79 | KDM4E (0.77) | KDM4ETDP1SMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL10094462 | 0.78 | TRPV1 (0.52) | KDM4ESMN1; SMN2HTTL3MBTL1TRPV1 | |
| SCHEMBL3712467 | 0.76 | KDM4E (0.67) | KDM4ETDP1SMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL31676801 | 0.76 | KDM4E (0.67) | KDM4ETDP1SMN1; SMN2L3MBTL1TRPV1 |
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-109608436-B | Substituted methyl formyl reagents and methods of using same to improve physicochemical and/or pharmacokinetic properties of compounds | 斯法尔制药私人有限公司 | 2022-10-11 | — | — | CN | disclosed |