Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.69 |
| ▸ | TSHR | P16473 | 3/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | USP2 | O75604 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL27918174 | 0.86 | SMN1; SMN2 (0.73) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 | |
| SCHEMBL5234913 | 0.84 | KDM4E (0.73) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 | |
| SCHEMBL8698562 | 0.83 | SMN1; SMN2 (0.69) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 | |
| SCHEMBL13453977 | 0.83 | SMN1; SMN2 (0.69) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 | |
| SCHEMBL25787580 | 0.80 | GAA (0.71) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 | |
| SCHEMBL14224489 | 0.79 | KMT2A (0.73) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 | |
| SCHEMBL18997524 | 0.79 | SMN1; SMN2 (0.63) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 | |
| SCHEMBL13417638 | 0.79 | SMN1; SMN2 (0.63) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 | |
| SCHEMBL15224256 | 0.79 | KMT2A (0.83) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 | |
| SCHEMBL27845891 | 0.77 | SMN1; SMN2 (0.61) | SMN1; SMN2TSHRKDM4EALOX15CYP1A2 |
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-105693718-A | Canthin-6-ketone derivative and preparation method and application thereof | 中国药科大学 | 2016-06-22 | — | — | CN | disclosed |