Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 10/20 | 0.38 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.35 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7128085 | 0.80 | EPHX2 (0.53) | HIF1AKCNK3KCNK9SMN1; SMN2MAPT | |
| SCHEMBL7984247 | 0.75 | NOS1 (0.48) | — | |
| SCHEMBL6962792 | 0.72 | KCNK3 (0.54) | KCNK3KCNK9SMN1; SMN2NPC1RAB9A | |
| SCHEMBL15499631 | 0.69 | NPC1 (0.50) | KCNK3KCNK9SMN1; SMN2NPC1RAB9A | |
| SCHEMBL6280367 | 0.68 | RAB9A (0.53) | KCNK3KCNK9SMN1; SMN2NPC1RAB9A | |
| SCHEMBL4396064 | 0.67 | SMN1; SMN2 (0.47) | KCNK3KCNK9SMN1; SMN2NPC1RAB9A | |
| SCHEMBL17794159 | 0.66 | KCNK3 (0.57) | KCNK3KCNK9SMN1; SMN2NPC1RAB9A | |
| Iodide SCHEMBL4402644 | 0.66 | SMN1; SMN2 (0.46) | KCNK3KCNK9SMN1; SMN2NPC1RAB9A | |
| SCHEMBL7084928 | 0.66 | KCNK3 (0.58) | KCNK3KCNK9SMN1; SMN2NPC1RAB9A | |
| SCHEMBL18994880 | 0.65 | SMN1; SMN2 (0.44) | KCNK3KCNK9SMN1; SMN2NPC1RAB9A |
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-2001087845-A2 | N-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE AS 5-HT ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-11-22 | — | — | WO | disclosed |