Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | PRCP | P42785 | 1/20 | 0.42 |
| ▸ | GID4 | Q8IVV7 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL15111039 | 0.90 | SLC6A2 (0.38) | SLC6A2ADRA1AHTR2BSLC6A3PRCP | |
| Oxazolidine SCHEMBL14720881 | 0.87 | SLC6A2 (0.36) | SLC6A2ADRA1AHTR2BSLC6A3PRCP | |
| SCHEMBL27407366 | 0.81 | TDP1 (0.43) | PRCPGAAKDM4EALDH1A1KDM1A | |
| SCHEMBL3769660 | 0.81 | CYP19A1 (0.39) | — | |
| SCHEMBL7358282 | 0.80 | GAA (0.38) | PRCPGID4GAAKDM4EALDH1A1 | |
| SCHEMBL7358289 | 0.80 | GAA (0.38) | PRCPGID4GAAKDM4EALDH1A1 | |
| SCHEMBL27093592 | 0.78 | TSHR (0.34) | GAARAB9AKMT2A | |
| SCHEMBL3777319 | 0.77 | GID4 (0.41) | SLC6A2ADRA1AHTR2BSLC6A3PRCP | |
| SCHEMBL11667059 | 0.74 | PRCP (0.51) | SLC6A2ADRA1AHTR2BSLC6A3PRCP | |
| SCHEMBL4757414 | 0.72 | HDAC8 (0.47) | PRCP |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1057296-C | Morpholine tachykinin receptor antagonists, their preparation and use | MERCK & CO INC (US) | 2000-10-11 | — | — | CN | disclosed |
| CN-1142819-A | Morpholine and thiomorpholine tachykinin receptor antagonists | MERCK & CO INC (US) | 1997-02-12 | — | — | CN | disclosed |
| EP-0748320-A1 | PRODRUGS OF MORPHOLINE TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO. INC. (US) | 1996-12-18 | — | — | EP | disclosed |