Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2130625 | 0.83 | TDP1 (0.43) | MEN1KMT2ACYP3A4LMNAHTT | |
| SCHEMBL2130629 | 0.83 | TDP1 (0.43) | MEN1KMT2ACYP3A4LMNAHTT | |
| SCHEMBL67953 | 0.83 | PTGS2 (0.47) | PTGS1PTGS2MEN1NPC1RAB9A | |
| SCHEMBL6438554 | 0.81 | RAB9A (0.54) | PTGS1PTGS2MEN1NPC1RAB9A | |
| SCHEMBL18069237 | 0.79 | LMNA (0.53) | MEN1KMT2ACYP3A4LMNAHTT | |
| SCHEMBL30782971 | 0.79 | LMNA (0.53) | MEN1KMT2ACYP3A4LMNAHTT | |
| SCHEMBL4579922 | 0.75 | MAPT (0.54) | KMT2ACYP3A4MAPTTDP1NR1H4 | |
| SCHEMBL4579930 | 0.75 | MAPT (0.54) | KMT2ACYP3A4MAPTTDP1NR1H4 | |
| SCHEMBL15630779 | 0.74 | LMNA (0.41) | NPC1RAB9ACYP3A4LMNAHTT | |
| SCHEMBL4324689 | 0.73 | ALDH1A1 (0.47) | PTGS1PTGS2MEN1KMT2ALMNA |
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-101563347-A | Vasopressin V1a antagonists | VANTIA LTD (GB) | 2009-10-21 | — | — | CN | disclosed |