Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK3 | O14649 | 2/20 | 0.55 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.55 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
| ▸ | CCND1 | P24385 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL12320839 | 0.88 | KCNK3 (0.57) | KCNK3KCNK9CDK4CCND1GRM5 | |
| SCHEMBL2407799 | 0.83 | KCNK3 (0.65) | KCNK3KCNK9CDK4CCND1GRM5 | |
| SCHEMBL12320837 | 0.79 | KCNK3 (0.61) | KCNK3KCNK9GRM5HPGDHTT | |
| SCHEMBL2407040 | 0.74 | KCNK3 (0.87) | KCNK3KCNK9MEN1ALDH1A1HPGD | |
| SCHEMBL30664070 | 0.71 | KCNK3 (1.00) | KCNK3KCNK9MEN1ALDH1A1HPGD | |
| SCHEMBL2406138 | 0.71 | KCNK3 (1.00) | KCNK3KCNK9MEN1ALDH1A1HPGD | |
| SCHEMBL2410232 | 0.70 | KCNK3 (0.72) | KCNK3KCNK9CDK4CCND1MAPT | |
| SCHEMBL2410478 | 0.70 | KCNK3 (0.73) | KCNK3KCNK9MEN1ALDH1A1KMT2A | |
| SCHEMBL2407042 | 0.68 | KCNK3 (0.68) | KCNK3KCNK9MEN1ALDH1A1KMT2A | |
| SCHEMBL2406140 | 0.67 | KCNK3 (0.66) | KCNK3KCNK9MEN1ALDH1A1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011106276-A1 | TASK CHANNEL ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-09-01 | — | — | WO | disclosed |
| WO-2011103715-A1 | TASK CHANNEL ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-09-01 | — | — | WO | disclosed |