Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.56 |
| ▸ | NPC1 | O15118 | 5/20 | 0.56 |
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.51 |
| ▸ | MGAM | O43451 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15903518 | 0.90 | RAB9A (0.52) | RAB9ANPC1MEN1KMT2AMGAM | |
| SCHEMBL5106250 | 0.87 | RAB9A (0.62) | RAB9ANPC1MEN1KMT2AMGAM | |
| SCHEMBL28978243 | 0.85 | NPC1 (0.49) | RAB9ANPC1MEN1KMT2AMGAM | |
| SCHEMBL8830688 | 0.84 | RAB9A (0.55) | RAB9ANPC1MEN1KMT2AMGAM | |
| SCHEMBL31038175 | 0.77 | CNR2 (0.57) | RAB9ANPC1MEN1KMT2AMGAM | |
| SCHEMBL8834901 | 0.77 | NPC1 (0.54) | RAB9ANPC1MEN1KMT2AMGAM | |
| SCHEMBL6257294 | 0.76 | BCAT2 (0.53) | RAB9ANPC1MEN1KMT2AMGAM | |
| SCHEMBL31531876 | 0.76 | BCAT2 (0.53) | RAB9ANPC1MEN1KMT2AMGAM | |
| SCHEMBL8326990 | 0.76 | RAB9A (0.53) | RAB9ANPC1MEN1KMT2AMGAM | |
| SCHEMBL5321419 | 0.76 | ALDH1A1 (0.59) | ALDH1A1KDM4EHPGDSMN1; SMN2CYP2C9 |
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-104607251-B | Frame compound catalyst material containing mixed valence Cu and preparation method thereof | 洛阳师范学院 | 2017-01-25 | — | — | CN | disclosed |