Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.41 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALPI | P09923 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2469547 | 0.80 | MAOA (0.50) | MAOAMAOBTSHRLMNAPLA2G10 | |
| SCHEMBL30589493 | 0.80 | MAOA (0.50) | MAOAMAOBTSHRLMNAPLA2G10 | |
| SCHEMBL28475617 | 0.77 | MAOA (0.47) | MAOAMAOBTSHRLMNAPLA2G10 | |
| SCHEMBL6244722 | 0.77 | MAOA (0.47) | MAOAMAOBTSHRLMNAPLA2G10 | |
| SCHEMBL15778347 | 0.76 | MAOA (0.36) | MAOAMAOBTSHRLMNAPLA2G10 | |
| SCHEMBL5526743 | 0.76 | MAOB (0.36) | MAOAMAOBTSHRALDH1A1HSD11B1 | |
| SCHEMBL2864888 | 0.76 | MAOA (0.46) | MAOAMAOBTSHRLMNAALDH1A1 | |
| SCHEMBL13538609 | 0.73 | MAOA (0.42) | MAOAMAOBTSHRLMNAPLA2G10 | |
| SCHEMBL8347656 | 0.73 | SLC6A2 (0.53) | MAOAMAOBTSHRALDH1A1CYP2D6 | |
| Hydrochloric Acid SCHEMBL8350781 | 0.72 | SLC6A2 (0.52) | MAOAMAOBTSHRALDH1A1CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113816858-B | Preparation method of trans-1, 2-diaminomethylcyclobutane and hydrochloride thereof | 四川汇宇制药股份有限公司 | 2023-03-17 | — | — | CN | claimed |
| CN-113816858-B | Preparation method of trans-1, 2-diaminomethylcyclobutane and hydrochloride thereof | 四川汇宇制药股份有限公司 | 2023-03-17 | — | — | CN | disclosed |
| CN-113816858-A | Preparation method of trans-1, 2-diaminomethylcyclobutane and hydrochloride thereof | 四川汇宇制药股份有限公司 | 2021-12-21 | — | — | CN | disclosed |