Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.39 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL1207219 | 0.81 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2ALMNA | |
| Biphenyl SCHEMBL28655421 | 0.81 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2ALMNA | |
| SCHEMBL25302717 | 0.80 | FFAR2 (0.44) | S1PR1ALDH1A1SMN1; SMN2LMNANPC1 | |
| SCHEMBL3238242 | 0.79 | NPSR1 (0.36) | ALDH1A1SMN1; SMN2MEN1KMT2ALMNA | |
| SCHEMBL4739711 | 0.79 | CA12 (0.42) | ALDH1A1SMN1; SMN2MEN1KMT2ALMNA | |
| Biphenyl SCHEMBL19181492 | 0.77 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2MEN1KMT2ALMNA | |
| SCHEMBL616 | 0.77 | ESR2 (0.54) | ALDH1A1SMN1; SMN2ENPP3ENPP1NPC1 | |
| SCHEMBL29706107 | 0.77 | ESR2 (0.54) | ALDH1A1SMN1; SMN2ENPP3ENPP1NPC1 | |
| SCHEMBL28793120 | 0.76 | ENPP3 (0.44) | ALDH1A1SMN1; SMN2ENPP3ENPP1NPC1 | |
| Biphenyl SCHEMBL19181494 | 0.76 | ALDH1A1 (0.38) | ALDH1A1MEN1KMT2ALMNARAB9A |
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-116410215-A | Aryl boric acid containing organic carbon free radical, derivative and preparation method thereof | 西安交通大学 | 2023-07-11 | — | — | CN | claimed |
| CN-116410215-A | Aryl boric acid containing organic carbon free radical, derivative and preparation method thereof | 西安交通大学 | 2023-07-11 | — | — | CN | disclosed |