Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.56 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 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 | |
|---|---|---|---|---|
| SCHEMBL25918159 | 0.86 | NPSR1 (0.70) | NPSR1KMT2AMEN1NPC1POLB | |
| SCHEMBL28291465 | 0.86 | NPSR1 (0.54) | NPSR1NPC1POLBRAB9ALMNA | |
| SCHEMBL28290036 | 0.82 | NPSR1 (0.60) | NPSR1KMT2AMEN1NPC1POLB | |
| SCHEMBL28291463 | 0.82 | NPSR1 (0.60) | NPSR1NPC1POLBRAB9AAPP | |
| SCHEMBL23953228 | 0.82 | MEN1 (0.44) | NPSR1KMT2AMEN1NPC1POLB | |
| SCHEMBL22080043 | 0.81 | KMT2A (0.54) | NPSR1KMT2AMEN1NPC1POLB | |
| SCHEMBL3859101 | 0.79 | MCHR1 (0.53) | NPSR1KMT2AMEN1NLRP3MAPT | |
| SCHEMBL3861889 | 0.79 | MCHR1 (0.64) | CYP3A4CYP1A2 | |
| SCHEMBL6241316 | 0.78 | NPC1 (0.65) | NPSR1KMT2AMEN1NPC1POLB | |
| SCHEMBL22079525 | 0.77 | NPSR1 (0.57) | NPSR1KMT2AMEN1NPC1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107337663-B | A kind of preparation method of thio three ketene compound of loop coil of visible light-inducing 3- | 曲阜师范大学 | 2019-09-17 | — | — | CN | disclosed |
| CN-107141248-B | A kind of method of visible light catalytic synthesis three ketene compound of 3- sulfuryl loop coil | 曲阜师范大学 | 2019-04-30 | — | — | CN | disclosed |