Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3389520 | 0.72 | KDM4E (0.43) | KDM4EPOLBALDH1A1HSD17B10HPGD | |
| SCHEMBL14190553 | 0.71 | PDE4D (0.56) | KDM4EPOLBALDH1A1L3MBTL1HSD17B10 | |
| SCHEMBL5417372 | 0.69 | KDM4E (0.53) | KDM4EPOLBALDH1A1MAPK1HSD17B10 | |
| SCHEMBL28835650 | 0.68 | HCAR2 (0.49) | KDM4EPOLBALDH1A1MAPK1L3MBTL1 | |
| SCHEMBL110117 | 0.68 | ALDH1A1 (0.60) | KDM4EALDH1A1MAPK1L3MBTL1HSD17B10 | |
| SCHEMBL19780350 | 0.68 | KDM4E (0.62) | KDM4EPOLBALDH1A1HSD17B10CYP1A2 | |
| SCHEMBL14518903 | 0.68 | P2RX7 (0.43) | KDM4EPOLBALDH1A1L3MBTL1HPGD | |
| SCHEMBL8354129 | 0.67 | KDM4E (0.49) | KDM4EPOLBALDH1A1HPGDCYP2C9 | |
| SCHEMBL6094592 | 0.67 | ALDH1A1 (0.51) | KDM4EALDH1A1MAPK1L3MBTL1HSD17B10 | |
| SCHEMBL2869702 | 0.66 | KDM4E (0.46) | KDM4EPOLBALDH1A1MAPK1L3MBTL1 |
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-1224187-A2 | CERTAIN ALKYLENE DIAMINE-SUBSTITUTED HETEROCYCLES | NEUROGEN CORPORATION (US) | 2002-07-24 | — | — | EP | disclosed |
| WO-2001023389-A2 | CERTAIN ALKYLENE DIAMINE-SUBSTITUTED HETEROCYCLES | NEUROGEN CORPORATION (US) | 2001-04-05 | — | — | WO | disclosed |