Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.65 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | HTR2B | P41595 | 3/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.39 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.39 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.39 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.39 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.39 |
| ▸ | TUBA1A | Q71U36 | 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 | |
|---|---|---|---|---|
| SCHEMBL30374 | 0.80 | PTGS2 (1.00) | PTGS2TUBB1HTR2AHTR2CHTR2B | |
| SCHEMBL8082037 | 0.77 | GAA (0.44) | KMT2A | |
| SCHEMBL20118746 | 0.75 | PTGS2 (0.67) | PTGS2TUBB1HTR2AHTR2CHTR2B | |
| SCHEMBL8080435 | 0.75 | MAPK1 (0.48) | PTGS2HTR2AHTR2CHTR2BCA9 | |
| SCHEMBL8082249 | 0.73 | TPMT (0.49) | PTGS2HTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL24498543 | 0.70 | PTGS2 (0.48) | PTGS2TUBB1HTR2AHTR2CHTR2B | |
| SCHEMBL12309883 | 0.70 | PTGS2 (0.76) | PTGS2TUBB1HTR2AHTR2CHTR2B | |
| SCHEMBL2500546 | 0.69 | PTGS2 (0.68) | PTGS2TUBB1HTR2AHTR2CHTR2B | |
| SCHEMBL10776221 | 0.69 | HTR1A (0.52) | PTGS2TUBB1HTR2AHTR2CHTR2B | |
| SCHEMBL8086437 | 0.69 | THRB (0.47) | — |
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-2015130547-A1 | BIS-CYCLIC GUANIDINE COMPOUND COMPOSITIONS, METHODS OF USE AND TREATMENT THEREOF | UNIVERSITY OF SOUTH FLORIDA (US) | 2015-09-03 | — | — | WO | disclosed |