Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 5/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 3/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL7824564 | 1.00 | NR3C1 (0.38) | NR3C1SLC6A2TACR1MDM2DRD2 | |
| SCHEMBL7824572 | 1.00 | NR3C1 (0.38) | NR3C1SLC6A2TACR1MDM2DRD2 | |
| SCHEMBL7828089 | 0.79 | TACR1 (0.51) | TACR1DRD2DRD3 | |
| SCHEMBL7828087 | 0.79 | TACR1 (0.51) | TACR1DRD2DRD3 | |
| SCHEMBL7833056 | 0.79 | TACR1 (0.51) | TACR1DRD2DRD3 | |
| SCHEMBL27365754 | 0.78 | TACR1 (0.53) | TACR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7837990 | 0.77 | TACR1 (0.52) | TACR1ALDH1A1 | |
| SCHEMBL27295072 | 0.76 | CYP2C9 (0.41) | — | |
| SCHEMBL27300413 | 0.76 | CYP2C9 (0.41) | — | |
| SCHEMBL27295071 | 0.76 | CYP2C9 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0655996-B1 | SUBSTITUTED BENZYLAMINO NITROGEN CONTAINING NON-AROMATIC HETEROCYCLES | PFIZER (US) | 2001-11-07 | — | — | EP | claimed |
| CN-1088917-A | Substituted benzylamino nitrogen-containing non-aromatic heterocyclic compounds | PFIZER (US) | 1994-07-06 | — | — | CN | claimed |