Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | OGA | O60502 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28494818 | 0.81 | KDM4E (0.49) | KDM4EGLARCE1LMNAMAOA | |
| SCHEMBL990162 | 0.79 | KDM4E (0.72) | KDM4EGLARCE1LMNAMAPT | |
| SCHEMBL7542105 | 0.76 | KDM4E (0.61) | KDM4EGLARCE1MAOAMAOB | |
| SCHEMBL3654274 | 0.76 | KDM4E (0.61) | KDM4EGLARCE1LMNAMAPT | |
| SCHEMBL12200072 | 0.74 | KDM4E (0.58) | KDM4EGLARCE1LMNAMAPT | |
| SCHEMBL990879 | 0.73 | KDM4E (0.64) | KDM4EGLARCE1LMNAMAPT | |
| Acetic Acid SCHEMBL2478031 | 0.73 | KDM4E (0.67) | KDM4EGLARCE1LMNAMAPT | |
| SCHEMBL1363642 | 0.71 | NOS3 (0.44) | KDM4EGLARCE1MAOBTAAR1 | |
| SCHEMBL1363818 | 0.70 | KDM4E (0.37) | KDM4EGLARCE1KCNH2MAOB | |
| SCHEMBL4098416 | 0.68 | KDM4E (0.73) | KDM4EGLARCE1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1200410-A1 | ISOQUINOLINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND A PROCESS FOR THE PREPARATION OF THE ACTIVE SUBSTANCE | Egis Gyogyszergyar Rt. (HU) | 2002-05-02 | — | — | EP | disclosed |
| WO-2001009101-A1 | ISOQUINOLINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND A PROCESS FOR THE PREPARATION OF THE ACTIVE SUBSTANCE | EGIS Gyógyszergyár Rt. (HU) | 2001-02-08 | — | — | WO | disclosed |