Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.39 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | GPR183 | P32249 | 1/20 | 0.39 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9481372 | 0.98 | PTGS2 (0.46) | PTGS2CYP3A4HTR2AKDM4ERAB9A | |
| SCHEMBL27955393 | 0.84 | PTGS2 (0.44) | PTGS2CYP3A4HTR2AKDM4ERAB9A | |
| SCHEMBL16683753 | 0.82 | PTGS2 (0.46) | PTGS2CYP3A4HTR2AKDM4ERAB9A | |
| SCHEMBL13362570 | 0.82 | PTGS2 (0.46) | PTGS2CYP3A4HTR2AKDM4ERAB9A | |
| SCHEMBL27318112 | 0.78 | SKP2 (0.44) | PTGS2CYP3A4HTR2AKDM4ERAB9A | |
| SCHEMBL3555634 | 0.78 | PTGS2 (0.48) | PTGS2CYP3A4HTR2AKDM4EGPR84 | |
| SCHEMBL9769261 | 0.78 | PTGS2 (0.45) | PTGS2CYP3A4HTR2AKDM4ERAB9A | |
| SCHEMBL2012315 | 0.78 | PTGS2 (0.48) | PTGS2CYP3A4HTR2AKDM4EGPR84 | |
| SCHEMBL17707867 | 0.78 | LTB4R (0.45) | PTGS2CYP3A4HTR2AKDM4EGPR84 | |
| SCHEMBL196514 | 0.78 | PTGS2 (0.48) | PTGS2CYP3A4HTR2AKDM4EGPR84 |
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-4992534-A | Anticarcinogenic agents with better water solubility, low toxicity, absorption and stability | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-02-12 | — | — | US | disclosed |