Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | MASP2 | O00187 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28069718 | 0.86 | SLC18A3 (0.53) | SLC18A3SIGMAR1AKR1C3AKR1C1SLC6A2 | |
| SCHEMBL27909987 | 0.82 | HDAC2 (0.45) | SLC18A3SIGMAR1AKR1C3AKR1C1GAA | |
| SCHEMBL19995526 | 0.82 | HDAC2 (0.45) | SLC18A3SIGMAR1AKR1C3AKR1C1GAA | |
| Hydrochloric Acid SCHEMBL19995976 | 0.81 | HDAC2 (0.44) | SLC18A3SIGMAR1AKR1C3AKR1C1GAA | |
| SCHEMBL28259358 | 0.74 | SLC6A2 (0.53) | SLC18A3SIGMAR1AKR1C3AKR1C1SLC6A2 | |
| SCHEMBL4237630 | 0.74 | SLC18A3 (0.55) | SLC18A3SIGMAR1AKR1C3AKR1C1SLC6A2 | |
| SCHEMBL5011948 | 0.74 | SLC18A3 (0.55) | SLC18A3SIGMAR1AKR1C3AKR1C1SLC6A2 | |
| SCHEMBL15580371 | 0.74 | SLC18A3 (0.55) | SLC18A3SIGMAR1AKR1C3AKR1C1SLC6A2 | |
| SCHEMBL29164408 | 0.74 | SLC18A3 (0.41) | SLC18A3SIGMAR1AKR1C3AKR1C1KMT2A | |
| SCHEMBL1477627 | 0.73 | SLC18A3 (0.53) | SLC18A3SIGMAR1AKR1C3AKR1C1SLC6A2 |
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-102119152-B | Organic compounds | NOVARTIS AG | 2014-07-02 | — | — | CN | disclosed |
| CN-102119152-A | Organic compounds | NOVARTIS AG | 2011-07-06 | — | — | CN | disclosed |