Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | PGK1 | P00558 | 2/20 | 0.34 |
| ▸ | KMO | O15229 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12600616 | 0.88 | KDM1A (0.33) | KMO | |
| SCHEMBL12600913 | 0.86 | KMO (0.30) | KMO | |
| SCHEMBL12600921 | 0.85 | CACNA1H (0.34) | — | |
| SCHEMBL12601124 | 0.83 | HTR2A (0.38) | HTR2AHTR2CKMO | |
| SCHEMBL12600614 | 0.80 | CYP11B2 (0.37) | KMO | |
| SCHEMBL12601088 | 0.77 | HTR2A (0.36) | HTR2AHTR2CKMO | |
| SCHEMBL33526183 | 0.76 | PGK1 (0.43) | HTR2AHTR2CPGK1KMO | |
| SCHEMBL12600918 | 0.74 | KMO (0.32) | KMO | |
| SCHEMBL1980047 | 0.72 | KMO (0.43) | KMO | |
| SCHEMBL33526553 | 0.71 | PGK1 (0.43) | HTR2AHTR2CPGK1KMO |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011072488-A1 | OXADIAZOLE SUBSTITUTED INDAZOLE DERIVATIVES FOR USE AS SPHINGOSINE 1-PHOSPHATE 1 (S1P1) RECEPTOR AGONISTS | GLAXO GROUP LIMITED (GB) | 2011-06-23 | — | — | WO | disclosed |