Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.38 |
| ▸ | TNKS | O95271 | 1/20 | 0.38 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.37 |
| ▸ | PDE4A | P27815 | 5/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5330187 | 1.00 | MEN1 (0.42) | MEN1KMT2AHTR2CTRPV6TNKS | |
| SCHEMBL5325094 | 0.84 | CES2 (0.41) | MEN1KMT2APDE4BPDE4APDE4C | |
| SCHEMBL5320501 | 0.84 | CES2 (0.41) | MEN1KMT2APDE4BPDE4APDE4C | |
| SCHEMBL5324581 | 0.84 | CES2 (0.41) | MEN1KMT2APDE4BPDE4APDE4C | |
| SCHEMBL5324527 | 0.84 | CES2 (0.41) | MEN1KMT2APDE4BPDE4APDE4C | |
| SCHEMBL5321802 | 0.84 | CES2 (0.41) | MEN1KMT2APDE4BPDE4APDE4C | |
| SCHEMBL5321151 | 0.82 | CYP2D6 (0.39) | KMT2ATRPV6HPGDHSD17B10 | |
| SCHEMBL5321156 | 0.82 | CYP2D6 (0.39) | KMT2ATRPV6HPGDHSD17B10 | |
| SCHEMBL5293012 | 0.81 | CES2 (0.37) | MEN1KMT2APDE4BPDE4APDE4C | |
| SCHEMBL5328233 | 0.80 | OPRM1 (0.35) | HPGDHSD17B10 |
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-2006129120-A9 | BENZOTRIAZEPINONE DERIVATIVES | JAMES BLACK FOUNDATION (GB) | 2007-03-22 | — | — | WO | disclosed |
| WO-2006129120-A2 | BENZOTRIAZEPINONE DERIVATIVES | JAMES BLACK FOUNDATION (GB) | 2006-12-07 | — | — | WO | disclosed |