Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 11/20 | 0.41 |
| ▸ | NOS3 | P29474 | 8/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7375148 | 1.00 | NOS2 (0.41) | NOS2NOS3BACE1OPRK1NPC1 | |
| SCHEMBL7420397 | 0.76 | NOS2 (0.49) | NOS2NOS3NOS1 | |
| SCHEMBL7417108 | 0.74 | BACE1 (0.51) | NOS2NOS3BACE1LMNA | |
| SCHEMBL14052957 | 0.72 | NOTUM (0.47) | OPRK1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL3030074 | 0.71 | OPRK1 (0.46) | NOS2NOS3BACE1OPRK1NPC1 | |
| SCHEMBL30569129 | 0.66 | — | — | |
| SCHEMBL2524058 | 0.66 | OPRK1 (0.58) | NOS2NOS3BACE1OPRK1NPC1 | |
| SCHEMBL3617351 | 0.66 | MAPK14 (0.34) | NOS2NOS3ALDH1A1GAA | |
| SCHEMBL7420414 | 0.65 | CYP1A2 (0.56) | NOS2NOS3BACE1OPRK1NPC1 | |
| SCHEMBL7375377 | 0.65 | NOS2 (0.42) | NOS2NOS3NPC1RAB9AKMT2A |
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-2000073313-A1 | NEW TRICYCLIC AMIDINE DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | ASTRAZENECA AB (SE) | 2000-12-07 | — | — | WO | claimed |