Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | CA5A | P35218 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 5/20 | 0.44 |
| ▸ | PTK2B | Q14289 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1227487 | 0.97 | CYP3A4 (0.52) | CYP3A4CYP1A2CYP2C9CYP2C19CA2 | |
| SCHEMBL11350253 | 0.95 | CYP3A4 (0.50) | CYP3A4CYP1A2CYP2C9CYP2C19CA2 | |
| Biphenyl SCHEMBL28050797 | 0.89 | CYP1A2 (0.50) | CYP3A4CYP1A2CYP2C9CYP2C19CA2 | |
| Ethylenediamine SCHEMBL10783198 | 0.87 | CYP3A4 (0.49) | CYP3A4CYP1A2CYP2C9CYP2C19CA2 | |
| SCHEMBL10424891 | 0.83 | SMN1; SMN2 (0.48) | CYP3A4CYP1A2CYP2C9CYP2C19CA2 | |
| SCHEMBL11649442 | 0.83 | CYP3A4 (0.48) | CYP3A4CYP1A2CYP2C9CYP2C19CA2 | |
| SCHEMBL11417790 | 0.82 | CYP3A4 (0.52) | CYP3A4CYP1A2CYP2C9CYP2C19CA2 | |
| SCHEMBL28050809 | 0.82 | HDAC8 (0.53) | CYP3A4CYP1A2CYP2C9CYP2C19CA2 | |
| SCHEMBL29733396 | 0.81 | CA2 (0.55) | CA2CA4CA5APOLBPTK2B | |
| SCHEMBL2173729 | 0.81 | CA2 (0.55) | CA2CA4CA5APOLBPTK2B |
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 |
|---|---|---|---|---|---|---|---|
| US-4307221-A | Fire-resistant (co)polycarbonates containing alkaline diesters or hemiesters of phosphonic acids | ATO CHIMIE (FR) | 1981-12-22 | — | — | US | disclosed |