Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAOA | P21397 | 3/20 | 0.44 |
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.39 |
| ▸ | ATG4B | Q9Y4P1 | 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 | |
|---|---|---|---|---|
| SCHEMBL7151676 | 1.00 | KDM4E (0.51) | KDM4EALDH1A1MAOAMAOBBCHE | |
| Mandelic Acid SCHEMBL7148240 | 0.85 | KDM4E (0.51) | KDM4EALDH1A1MAOAMAOBBCHE | |
| Mandelic Acid SCHEMBL7149974 | 0.85 | KDM4E (0.51) | KDM4EALDH1A1MAOAMAOBBCHE | |
| Mandelic Acid SCHEMBL7144638 | 0.83 | KDM4E (0.52) | KDM4EALDH1A1MAOAMAOBBCHE | |
| Mandelic Acid SCHEMBL7147248 | 0.83 | KDM4E (0.52) | KDM4EALDH1A1MAOAMAOBBCHE | |
| SCHEMBL7146949 | 0.79 | GRIN2B (0.62) | KDM4EALDH1A1MAOAMAOBBCHE | |
| SCHEMBL18722296 | 0.79 | GRIN2B (0.62) | KDM4EALDH1A1MAOAMAOBBCHE | |
| SCHEMBL2160788 | 0.79 | GRIN2B (0.62) | KDM4EALDH1A1MAOAMAOBBCHE | |
| SCHEMBL7149968 | 0.79 | GRIN2B (0.62) | KDM4EALDH1A1MAOAMAOBBCHE | |
| Hydrochloric Acid SCHEMBL5969839 | 0.78 | GRIN2B (0.60) | KDM4EALDH1A1MAOAMAOBBCHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996021640-A1 | OPTICALLY ACTIVE AMINOINDANE DERIVATIVES AND PREPARATION THEREOF | TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) | 1996-07-18 | — | — | WO | disclosed |