Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.48 |
| ▸ | NOS1 | P29475 | 2/20 | 0.48 |
| ▸ | NOS2 | P35228 | 2/20 | 0.48 |
| ▸ | CRHBP | P24387 | 4/20 | 0.42 |
| ▸ | CRHR2 | Q13324 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL6510782 | 0.90 | NOS3 (0.45) | NOS3NOS1NOS2CRHBPCRHR2 | |
| SCHEMBL6509226 | 0.88 | NOS3 (0.46) | NOS3NOS1NOS2LMNASMN1; SMN2 | |
| SCHEMBL6515597 | 0.84 | NOS3 (0.45) | NOS3NOS1NOS2CRHBPCRHR2 | |
| SCHEMBL6518218 | 0.82 | RECQL (0.51) | NOS3NOS1NOS2MEN1KMT2A | |
| SCHEMBL6509756 | 0.81 | KMT2A (0.47) | CRHBPCRHR2MEN1KMT2ALMNA | |
| SCHEMBL6513366 | 0.81 | ALDH1A1 (0.53) | NOS3NOS1NOS2MEN1KMT2A | |
| SCHEMBL6155618 | 0.78 | SIGMAR1 (0.54) | NOS3NOS1NOS2KMT2ALMNA | |
| SCHEMBL6513314 | 0.77 | ALDH1A1 (0.47) | NOS3NOS1NOS2MEN1KMT2A | |
| SCHEMBL10501444 | 0.77 | CYP1A2 (0.49) | CRHBPCRHR2MEN1KMT2ALMNA | |
| SCHEMBL10501448 | 0.77 | CYP1A2 (0.49) | CRHBPCRHR2MEN1KMT2ALMNA |
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-2005095345-A2 | HETEROARYL GUANIDINES AS INHIBITORS OF VIRAL REPLICATION | ACHILLION PHARMACEUTICALS, INC. (US) | 2005-10-13 | — | — | WO | claimed |