Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 6/20 | 0.41 |
| ▸ | CDK8 | P49336 | 6/20 | 0.41 |
| ▸ | PIM1 | P11309 | 2/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | BLVRB | P30043 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | CDC7 | O00311 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14286138 | 0.79 | GSK3B (0.45) | — | |
| SCHEMBL14600752 | 0.77 | NPC1 (0.36) | PIM1PIM2NPC1RAB9APIM3 | |
| SCHEMBL5042374 | 0.68 | BCAT1 (0.45) | CCNCCDK8PIM1PIM2NPC1 | |
| SCHEMBL14286122 | 0.67 | POLB (0.48) | CCNCCDK8PIM1PIM2NPC1 | |
| SCHEMBL20792832 | 0.67 | CCNC (0.50) | CCNCCDK8PIM1PIM2SLC9A1 | |
| SCHEMBL30882693 | 0.66 | MCL1 (0.51) | CCNCCDK8PIM1PIM2POLB | |
| SCHEMBL30471591 | 0.65 | CCNC (0.55) | CCNCCDK8CDC7 | |
| SCHEMBL13175847 | 0.63 | ACMSD (0.50) | RAB9AMAOABLVRBHDAC6 | |
| SCHEMBL20742135 | 0.63 | CCNC (0.65) | CCNCCDK8POLBCDC7 | |
| SCHEMBL5047846 | 0.62 | MAPK1 (0.47) | NPC1RAB9APOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-7314885-B2 | Pyrrole compounds useful as kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-01-01 | — | — | US | disclosed |
| US-7314885-B2 | Pyrrole compounds useful as kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-01-01 | — | — | US | disclosed |