Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 6/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.65 |
| ▸ | CTSD | P07339 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.51 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | STAT3 | P40763 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL29432808 | 0.92 | SMN1; SMN2 (0.68) | LMNASMN1; SMN2CTSDHTTMAPT | |
| SCHEMBL54071 | 0.92 | SMN1; SMN2 (0.68) | LMNASMN1; SMN2CTSDHTTMAPT | |
| SCHEMBL27822540 | 0.90 | SMN1; SMN2 (0.66) | LMNASMN1; SMN2CTSDHTTMAPT | |
| Formaldehyde SCHEMBL28303539 | 0.88 | SMN1; SMN2 (0.64) | LMNASMN1; SMN2CTSDHTTMAPT | |
| Acetophenone SCHEMBL14657382 | 0.83 | RAB9A (0.60) | LMNASMN1; SMN2CTSDHTTMAPT | |
| Anisole SCHEMBL11530565 | 0.83 | LMNA (0.58) | LMNASMN1; SMN2CTSDHTTMAPT | |
| SCHEMBL20323265 | 0.81 | KMT2A (0.68) | LMNASMN1; SMN2CTSDHTTMAPT | |
| SCHEMBL6488893 | 0.81 | NPC1 (0.62) | LMNASMN1; SMN2CTSDHTTL3MBTL1 | |
| SCHEMBL20832514 | 0.81 | LMNA (0.56) | LMNASMN1; SMN2CTSDHTTMAPT | |
| SCHEMBL27679505 | 0.81 | HTT (0.73) | LMNASMN1; SMN2CTSDHTTMAPT |
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-112876482-A | Polysubstituted heterocyclic derivative, preparation method and medical application thereof | 中国药科大学 | 2021-06-01 | — | — | CN | disclosed |