Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13159623 | 0.73 | IDO1 (0.44) | ALDH1A1GAAHTTTDP1KMT2A | |
| SCHEMBL25192583 | 0.72 | ALDH1A1 (0.48) | ALDH1A1KDM4ETDP1MAPK1KMT2A | |
| SCHEMBL19628899 | 0.72 | ALDH1A1 (0.48) | ALDH1A1KDM4ETDP1MAPK1KMT2A | |
| SCHEMBL7762059 | 0.72 | KMT2A (0.43) | ALDH1A1GAAKDM4EHTTTDP1 | |
| SCHEMBL6404409 | 0.72 | KDM4E (0.49) | ALDH1A1GAAKDM4EHTTTDP1 | |
| SCHEMBL15878732 | 0.72 | ALDH1A1 (0.39) | ALDH1A1GAAKDM4EHTTTDP1 | |
| SCHEMBL10699791 | 0.72 | ALDH1A1 (0.56) | ALDH1A1KDM4EKMT2APOLBHSD17B10 | |
| SCHEMBL13154528 | 0.71 | NPSR1 (0.44) | ALDH1A1GAAKDM4ETDP1KMT2A | |
| SCHEMBL25039465 | 0.70 | CA1 (0.44) | ALDH1A1GAAHTTMAPK1KMT2A | |
| SCHEMBL20420118 | 0.70 | POLB (0.42) | ALDH1A1GAAHTTMAPK1POLB |
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-116891495-A | Hydrophilic equilateral triangle BODIPY fluorescent probe 3N-BDP and preparation method thereof | 淮阴工学院 | 2023-10-17 | — | — | CN | disclosed |