Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 10/20 | 0.61 |
| ▸ | KMO | O15229 | 1/20 | 0.56 |
| ▸ | NOS3 | P29474 | 6/20 | 0.54 |
| ▸ | NOS1 | P29475 | 6/20 | 0.54 |
| ▸ | NOS2 | P35228 | 6/20 | 0.54 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL536309 | 0.89 | TDP1 (0.47) | IDO1KMONOS3NOS1NOS2 | |
| SCHEMBL9715941 | 0.86 | IDO1 (0.61) | IDO1KMONOS3NOS1NOS2 | |
| SCHEMBL9716064 | 0.83 | CD74 (0.57) | IDO1 | |
| SCHEMBL9715926 | 0.83 | CBX7 (0.47) | IDO1KMO | |
| SCHEMBL9716028 | 0.83 | MIF (0.57) | — | |
| SCHEMBL9715996 | 0.82 | KMO (0.54) | IDO1KMONOS3NOS1NOS2 | |
| SCHEMBL9716003 | 0.82 | IDO1 (0.64) | IDO1KMONOS3NOS1NOS2 | |
| SCHEMBL9715947 | 0.81 | KMO (0.60) | IDO1KMONOS3NOS1NOS2 | |
| SCHEMBL9715986 | 0.80 | KMO (0.43) | IDO1KMONOS3NOS1NOS2 | |
| SCHEMBL9715940 | 0.80 | KMO (0.58) | KMO |
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-5102898-A | Halosubstituted alkyne group; fungicides | ROHM AND HAAS COMPANY (US) | 1992-04-07 | — | — | US | disclosed |