Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CCR2 | P41597 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.43 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2214735 | 0.90 | CYP19A1 (0.47) | CYP19A1KDM4EHSD17B10CYP1A2CYP2C9 | |
| SCHEMBL28273846 | 0.90 | CYP19A1 (0.47) | CYP19A1KDM4EHSD17B10CYP1A2CYP2C9 | |
| SCHEMBL28273845 | 0.90 | CYP19A1 (0.47) | CYP19A1KDM4EHSD17B10CYP1A2CYP2C9 | |
| SCHEMBL28273840 | 0.89 | CYP19A1 (0.46) | CYP19A1KDM4EHSD17B10CYP1A2CYP2C9 | |
| SCHEMBL2212262 | 0.88 | PDE4A (0.48) | CYP19A1KDM4EHSD17B10CYP1A2CYP2C9 | |
| SCHEMBL2218201 | 0.86 | AGTR1 (0.47) | CYP19A1KDM4EHSD17B10CYP1A2CYP2C9 | |
| SCHEMBL2215283 | 0.85 | CYP19A1 (0.49) | CYP19A1KDM4EHSD17B10CYP1A2CYP2C9 | |
| SCHEMBL29217042 | 0.84 | KDM4E (0.53) | KDM4EHSD17B10CCR2MEN1KMT2A | |
| SCHEMBL29217015 | 0.84 | CCR2 (0.48) | KDM4EHSD17B10CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29217013 | 0.83 | MEN1 (0.48) | KDM4EHSD17B10L3MBTL1CCR2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1634881-B1 | HARMINE DERIVATIVES, INTERMEDIATES USED IN THEIR PREPARATION, PREPARATION PROCESSES AND USE THEREOF | XINJIANG HUASHIDAN PHARMACEUTICAL RES CO LTD (CN) | 2011-07-27 | — | — | EP | claimed |