Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 7/20 | 0.56 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | GRM5 | P41594 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28053933 | 0.88 | MAOB (0.54) | GRM4P2RX3ALDH1A1KDM4EHPGD | |
| SCHEMBL28053802 | 0.82 | ALOX5 (0.47) | GRM4P2RX3ALDH1A1KDM4EHPGD | |
| SCHEMBL28053931 | 0.80 | NFE2L2 (0.55) | GRM4ALDH1A1KDM4ERAB9AMEN1 | |
| SCHEMBL28053952 | 0.80 | CYP11B1 (0.56) | GRM4KDM4ERAB9AMEN1KMT2A | |
| SCHEMBL20144415 | 0.79 | BCHE (0.44) | PTGS1PTGS2 | |
| SCHEMBL28053932 | 0.77 | RELA (0.58) | ALDH1A1KDM4EHPGDRAB9ANPC1 | |
| SCHEMBL6323560 | 0.77 | MEN1 (0.54) | GRM4ALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL6323554 | 0.77 | MEN1 (0.54) | GRM4ALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL10719653 | 0.73 | GRM4 (0.50) | GRM4P2RX3ALDH1A1KDM4EHPGD | |
| SCHEMBL22721962 | 0.73 | CHAT (0.45) | ALDH1A1KDM4EHPGDRAB9AMEN1 |
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-103864768-B | Ligustrazine stilbenoids derivatives and preparation method thereof and application | GUANGXI NORMAL UNIVERSITY (CN) | 2016-04-06 | — | — | CN | disclosed |