Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.47 |
| ▸ | GPR3 | P46089 | 1/20 | 0.47 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 2/20 | 0.41 |
| ▸ | F12 | P00748 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | GLA | P06280 | 3/20 | 0.40 |
| ▸ | CASP1 | P29466 | 2/20 | 0.40 |
| ▸ | CASP7 | P55210 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28301397 | 0.78 | KDM4E (0.50) | KDM4EGPR3PDPK1PLAUF12 | |
| SCHEMBL9125784 | 0.78 | KDM4E (0.50) | KDM4EGPR3ALDH1A1HSD17B10SMN1; SMN2 | |
| SCHEMBL30790223 | 0.78 | KDM4E (0.50) | KDM4EGPR3ALDH1A1HSD17B10SMN1; SMN2 | |
| SCHEMBL2747465 | 0.77 | KDM4E (0.48) | KDM4EGPR3PDPK1ALDH1A1HSD17B10 | |
| SCHEMBL17942817 | 0.77 | KDM4E (0.48) | KDM4EGPR3PDPK1PLAUF12 | |
| SCHEMBL2747868 | 0.75 | KDM4E (0.47) | KDM4EGPR3ALDH1A1HPGDHSD17B10 | |
| SCHEMBL3293976 | 0.75 | KDM4E (0.47) | KDM4EGPR3PDPK1PLAUF12 | |
| SCHEMBL38666100 | 0.75 | KDM4E (0.47) | KDM4EGPR3PDPK1PLAUF12 | |
| SCHEMBL7315366 | 0.75 | POLB (0.50) | KDM4EGPR3PDPK1PLAUALDH1A1 | |
| SCHEMBL3298150 | 0.75 | KDM4E (0.47) | KDM4EGPR3PDPK1PLAUF12 |
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-4880817-A | O-functionalized derivatives of substituted isoquinolin-3-ols having cardiotonic and/or phosphodiesterase fraction III inhibiting properties and/or renal vasodilating properties | ORTHO PHARMACEUTICAL CORPORATION (US) | 1989-11-14 | — | — | US | disclosed |