Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7829339 | 0.77 | HSD17B10 (0.40) | SLC6A2SLC6A4SLC6A3HPGDCYP3A4 | |
| SCHEMBL27390102 | 0.76 | SRC (0.56) | HPGDCYP2C19KDM4ELMNASRC | |
| SCHEMBL115280 | 0.76 | HSD17B10 (0.39) | SLC6A2SLC6A4SLC6A3HPGDCYP3A4 | |
| SCHEMBL1645022 | 0.76 | HPGD (0.43) | SLC6A2SLC6A4SLC6A3HPGDCYP3A4 | |
| SCHEMBL27445792 | 0.75 | NAPRT (0.50) | SLC6A2SLC6A4SLC6A3CYP19A1CYP17A1 | |
| SCHEMBL11554283 | 0.74 | HPGD (0.42) | SLC6A2SLC6A4SLC6A3HPGDCYP3A4 | |
| SCHEMBL1439868 | 0.72 | SLC6A3 (0.54) | SLC6A2SLC6A4SLC6A3CYP2C19HSD17B10 | |
| SCHEMBL11576019 | 0.71 | HPGD (0.33) | SLC6A2SLC6A4SLC6A3HPGDCYP3A4 | |
| SCHEMBL27453965 | 0.71 | SLC6A2 (0.33) | SLC6A2SLC6A4SLC6A3HPGDCYP3A4 | |
| SCHEMBL27453963 | 0.70 | HPGD (0.39) | SLC6A2SLC6A4SLC6A3HPGDCYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1098716-A | Vasopressin antagonists and oxytocin antagonists | OTSUKA CHEMICAL CO LTD (JP) | 1995-02-15 | — | — | CN | disclosed |