Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 14/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 14/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 14/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28268801 | 1.00 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3CYP2D6MAOA | |
| SCHEMBL5231364 | 0.85 | TACR1 (0.49) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL5787980 | 0.78 | LMNA (0.42) | SLC6A2SLC6A4SLC6A3CYP2D6MAOA | |
| SCHEMBL27552517 | 0.77 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3CYP2D6MAOA | |
| SCHEMBL10798557 | 0.76 | TACR3 (0.39) | MAOAMAOB | |
| SCHEMBL28125339 | 0.75 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3CYP2D6MAOA | |
| SCHEMBL27451724 | 0.74 | NPC1 (0.38) | — | |
| SCHEMBL27552516 | 0.73 | KMT2A (0.39) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| SCHEMBL19499577 | 0.72 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL17726123 | 0.72 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109320515-A | A kind of method of asymmetric synthesis of Capromorelin chiral intermediate | 常州大学 | 2019-02-12 | — | — | CN | claimed |
| CN-109320515-A | A kind of method of asymmetric synthesis of Capromorelin chiral intermediate | 常州大学 | 2019-02-12 | — | — | CN | disclosed |