Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | NOS2 | P35228 | 10/20 | 0.57 |
| ▸ | NOS3 | P29474 | 7/20 | 0.57 |
| ▸ | NOS1 | P29475 | 7/20 | 0.57 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.50 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.50 |
| ▸ | ITGAL | P20701 | 1/20 | 0.50 |
| ▸ | HTR1D | P28221 | 2/20 | 0.49 |
| ▸ | HTR2C | P28335 | 2/20 | 0.49 |
| ▸ | HTR1E | P28566 | 2/20 | 0.49 |
| ▸ | HTR2B | P41595 | 2/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR3A | P46098 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.47 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11158707 | 0.81 | ITGB2 (0.58) | ITGB2ICAM1ITGALHTR1DHTR2C | |
| SCHEMBL4535076 | 0.80 | HTR1D (0.48) | ITGB2ICAM1ITGALHTR1DHTR2C | |
| SCHEMBL29040563 | 0.80 | NOS2 (0.84) | NOS2NOS3NOS1CNR2 | |
| SCHEMBL29040561 | 0.80 | NOS2 (0.84) | NOS2NOS3NOS1CNR2 | |
| SCHEMBL7598348 | 0.80 | ITGB2 (0.55) | ITGB2ICAM1ITGALHTR1DHTR2C | |
| SCHEMBL9875941 | 0.78 | MME (0.59) | HTR1DHTR2CHTR1EHTR2BHTR2A | |
| SCHEMBL5808674 | 0.77 | HTR1D (0.51) | ITGB2ICAM1ITGALHTR1DHTR2C | |
| SCHEMBL27342814 | 0.76 | REN (0.56) | ITGB2ICAM1ITGALHTR1DHTR2C | |
| SCHEMBL1711193 | 0.76 | NOS2 (0.73) | NOS2NOS3NOS1CNR2 | |
| SCHEMBL2059180 | 0.76 | SIRT2 (0.52) | ITGB2ICAM1ITGALHTR1DHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-1982716-A1 | NOVEL HISTIDINE DERIVATIVE | Nippon Zoki Pharmaceutical Co. Ltd. (JP) | 2008-10-22 | — | — | EP | disclosed |