Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4754375 | 0.90 | HTT (0.43) | SLC6A4CASRMAPTTSHRMAPK1 | |
| SCHEMBL4754003 | 0.88 | SLC6A4 (0.44) | SLC6A4CASRMAPTTSHRMAPK1 | |
| SCHEMBL4753692 | 0.78 | HTT (0.42) | SLC6A4CASRMAPTTSHRMAPK1 | |
| SCHEMBL4756964 | 0.76 | REN (0.41) | SLC6A4CASRMAPTTSHRMAPK1 | |
| SCHEMBL4757031 | 0.76 | EPHX2 (0.41) | SLC6A4CASRMAPTTSHRMAPK1 | |
| SCHEMBL4755348 | 0.75 | SLC6A4 (0.43) | SLC6A4CASRMAPTTSHRMAPK1 | |
| SCHEMBL13851585 | 0.75 | CTSA (0.49) | MEN1KMT2ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL27752438 | 0.73 | WDR5 (0.50) | MAPTMEN1KMT2AALDH1A1HPGD | |
| SCHEMBL14252613 | 0.73 | ADRB2 (0.43) | SLC6A4MAPK1ALDH1A1HPGD | |
| SCHEMBL14338095 | 0.73 | ADRB2 (0.43) | SLC6A4MAPK1ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008156816-A2 | RENIN INHIBITORS | VITAE PHARMACEUTICALS, INC. (US) | 2008-12-24 | — | — | WO | disclosed |