Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23610032 | 0.86 | BRD4 (0.46) | BRD4SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL31143703 | 0.86 | BRD4 (0.46) | BRD4SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL30392540 | 0.86 | BRD4 (0.46) | BRD4SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL31143613 | 0.86 | BRD4 (0.46) | BRD4SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL9003879 | 0.86 | BRD4 (0.46) | BRD4SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL14081505 | 0.84 | BRD4 (0.49) | BRD4SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL29485027 | 0.84 | BRD4 (0.49) | BRD4SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL23610040 | 0.84 | BRD4 (0.49) | BRD4SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL23610057 | 0.79 | SLC6A2 (0.63) | BRD4SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL477369 | 0.79 | SLC6A2 (0.63) | BRD4SLC6A3SLC6A2SLC6A4MAPT |
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-2010067233-A1 | 1,2,4 TRIAZOLO [4, 3 -A] [1,5] BENZODIAZEPIN-5 (6H) -ONES AS AGONISTS OF THE CHOLECYSTOKININ-1 RECEPTOR (CCK-IR) | PFIZER INC. (US) | 2010-06-17 | — | — | WO | disclosed |
| WO-2010067233-A1 | 1,2,4 TRIAZOLO [4, 3 -A] [1,5] BENZODIAZEPIN-5 (6H) -ONES AS AGONISTS OF THE CHOLECYSTOKININ-1 RECEPTOR (CCK-IR) | PFIZER INC. (US) | 2010-06-17 | — | — | WO | disclosed |