Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7587251 | 0.83 | PARP10 (0.54) | BRD4CYP2A6MAOAMAOBLMNA | |
| SCHEMBL28004729 | 0.81 | PARP10 (0.49) | BRD4CYP2A6MAOAMAOBGRM5 | |
| SCHEMBL23273185 | 0.79 | PARP10 (0.54) | BRD4CYP2A6MAOAMAOBLMNA | |
| SCHEMBL13923767 | 0.75 | BRD4 (0.42) | BRD4GRM5LMNAKDM4EALDH1A1 | |
| SCHEMBL21500405 | 0.73 | PARP1 (0.44) | CYP1A2HPGDCYP2C19NPC1RAB9A | |
| SCHEMBL28041457 | 0.71 | MAOA (0.56) | BRD4CYP2A6MAOAMAOBKDM4E | |
| SCHEMBL7179331 | 0.71 | PARP10 (0.58) | CYP2A6MAOAMAOBKDM4EALDH1A1 | |
| SCHEMBL7413330 | 0.70 | BRD4 (0.48) | BRD4CYP2A6MAOAMAOBGRM5 | |
| SCHEMBL13923765 | 0.70 | PARP10 (0.61) | BRD4GRM5KDM4EALDH1A1HPGD | |
| SCHEMBL7680896 | 0.70 | BRD4 (0.65) | BRD4CYP2A6MAOAMAOBLMNA |
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-105111228-A | Chiral phosphoric acid with 5,5'-bitetralone skeleton and preparation method thereof | NANJING UNIVERSITY OF TECHNOLOGY | 2015-12-02 | — | — | CN | disclosed |