Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | CCR8 | P51685 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL28749349 | 0.79 | NOS2 (0.50) | NOS2KDM4EMEN1NOS3NOS1 | |
| SCHEMBL4428487 | 0.79 | NOS2 (0.50) | NOS2KDM4EMEN1NOS3NOS1 | |
| Hydrochloric Acid SCHEMBL31482081 | 0.77 | NOS2 (0.48) | NOS2KDM4EMEN1NOS3NOS1 | |
| SCHEMBL6513811 | 0.76 | S1PR2 (0.48) | NOS2KDM4ENOS3CCR1CCR5 | |
| SCHEMBL23619200 | 0.76 | SLC6A2 (0.46) | MEN1KMT2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2111803 | 0.75 | SLC6A2 (0.63) | KDM4ESLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL3384423 | 0.75 | SLC6A2 (0.63) | KDM4ESLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL6766141 | 0.75 | SLC6A2 (0.63) | KDM4ESLC6A2SLC6A4SLC6A3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7226415 | 0.73 | SLC6A2 (0.61) | KDM4ESLC6A2SLC6A4SLC6A3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4509965 | 0.73 | SLC6A2 (0.61) | KDM4ESLC6A2SLC6A4SLC6A3ALDH1A1 |
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-2005023794-A2 | COMPOUND LIBRARIES OF 4-CARBOXAMIDOPIPERIDINE DERIVATIVES | BIOFOCUS PLC (GB) | 2005-03-17 | — | — | WO | disclosed |
| WO-2004058755-A2 | COMPOUND LIBRARIES OF IMIDAZO[1,5-A]PYRIDIN-3-YL DERIVATIVES AND RELATED HETEROBICYCLES FOR TARGETTING COMPOUNDS CAPABLE OF BINDING TO G-PROTEIN COUPLED RECEPTORS | BIOFOCUS PLC (GB) | 2004-07-15 | — | — | WO | disclosed |