Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 4/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 4/20 | 0.32 |
| ▸ | PDK3 | Q15120 | 4/20 | 0.32 |
| ▸ | PDK4 | Q16654 | 4/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | WDR5 | P61964 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL8634375 | 0.85 | MAPT (0.37) | MAPTALDH1A1LMNAPDK1PDK2 | |
| SCHEMBL8628399 | 0.82 | ALDH1A1 (0.37) | MAPTALDH1A1LMNAMEN1HTT | |
| SCHEMBL8630392 | 0.81 | ALDH1A1 (0.34) | MAPTALDH1A1LMNAPDK1PDK2 | |
| SCHEMBL8630394 | 0.75 | ALDH1A1 (0.34) | MAPTALDH1A1LMNAPDK1PDK2 | |
| Iodide SCHEMBL8634376 | 0.74 | KDM4E (0.38) | MAPTALDH1A1LMNAPDK1PDK2 | |
| SCHEMBL8627671 | 0.72 | AVPR2 (0.37) | MAPTALDH1A1LMNARAB9AMEN1 | |
| SCHEMBL8628401 | 0.70 | ALDH1A1 (0.37) | MAPTALDH1A1LMNAPDK1PDK2 | |
| SCHEMBL4682375 | 0.67 | ALDH1A1 (0.38) | MAPTALDH1A1LMNAMEN1HTT | |
| SCHEMBL8634457 | 0.66 | TP53 (0.34) | MAPTALDH1A1POLBMEN1KMT2A | |
| SCHEMBL8627674 | 0.66 | AVPR2 (0.38) | MAPTALDH1A1LMNARAB9AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5753644-A | Vasopressin antagonist and oxytocin antagonist | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-05-19 | — | — | US | disclosed |