Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.34 |
| ▸ | CCNK | O75909 | 2/20 | 0.34 |
| ▸ | CDK9 | P50750 | 2/20 | 0.34 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.34 |
| ▸ | CDK7 | P50613 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6028530 | 0.91 | CHEK1 (0.37) | NPC1HPGDRAB9ASLC6A2SLC6A4 | |
| SCHEMBL7829393 | 0.86 | SLC6A4 (0.38) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6028983 | 0.85 | CDK2 (0.38) | HPGDMAPK1KCNH2CHEK1JAK1 | |
| SCHEMBL6028919 | 0.83 | CHEK1 (0.39) | KCNH2NTRK1CHEK1JAK1JAK3 | |
| SCHEMBL6029102 | 0.83 | CHEK1 (0.39) | HPGDMAPK1NTRK1CHEK1CCNT1 | |
| SCHEMBL6028900 | 0.81 | CDK8 (0.36) | MAPK1SMN1; SMN2NTRK1CHEK1JAK1 | |
| SCHEMBL6030341 | 0.81 | CHEK1 (0.36) | KCNH2CHEK1JAK1JAK3SIGMAR1 | |
| SCHEMBL6030280 | 0.80 | NTRK1 (0.39) | KCNH2NTRK1CHEK1JAK1JAK3 | |
| SCHEMBL6029129 | 0.80 | CHEK1 (0.35) | RAB9AKCNH2CHEK1JAK1JAK3 | |
| SCHEMBL6028338 | 0.79 | CHEK1 (0.40) | SLC6A2SLC6A4SLC6A3KCNH2CHEK1 |
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-6984643-B2 | 2,5-substituted pyrimidine derivatives-CCR-3 receptor antagonists | ROCHE PALO ALTO LLC (US) | 2006-01-10 | — | — | US | disclosed |