Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 17/20 | 0.77 |
| ▸ | MET | P08581 | 1/20 | 0.62 |
| ▸ | BCHE | P06276 | 2/20 | 0.59 |
| ▸ | ACHE | P22303 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | XDH | P47989 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL3296967 | 0.88 | MAOB (0.79) | MAOBMETBCHEACHEKDM4E | |
| Hydrochloric Acid SCHEMBL4224579 | 0.86 | KDM4E (0.67) | MAOBKDM4EALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5935375 | 0.85 | MAOB (0.60) | MAOBACHEKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL4229987 | 0.83 | MAOB (0.58) | MAOBKDM4EALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5935403 | 0.82 | MAOB (0.57) | MAOBKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL3573974 | 0.80 | HRH3 (0.75) | ACHEALDH1A1 | |
| SCHEMBL5685709 | 0.80 | HRH3 (0.72) | MAOBACHEKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL4688676 | 0.79 | HRH3 (0.72) | ACHEKDM4EALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4224523 | 0.79 | HRH3 (0.71) | MAOBACHEKDM4EALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4235034 | 0.79 | KDM4E (0.71) | MAOBKDM4EALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102746255-A | Compound having anti-tumor activity, and preparation method and application thereof | ANHUI UNIVERSITY OF TRADITIONAL CHINESE MEDCINE | 2012-10-24 | — | — | CN | disclosed |