Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 8/20 | 0.43 |
| ▸ | MAOA | P21397 | 5/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9004256 | 0.86 | DPP4 (0.42) | MAOBMAOA | |
| SCHEMBL13562892 | 0.79 | MAOB (0.48) | MAOBMAOAOPRM1OPRK1OPRL1 | |
| SCHEMBL19992871 | 0.70 | MAOB (0.48) | MAOBMAOAOPRM1OPRK1OPRL1 | |
| SCHEMBL753111 | 0.70 | DPP4 (0.44) | MAOBMAOAOPRM1OPRK1OPRL1 | |
| SCHEMBL30807073 | 0.69 | MAOB (0.60) | MAOBMAOAOPRM1OPRK1OPRL1 | |
| SCHEMBL19717562 | 0.69 | AKR1B1 (0.41) | MAOBMAOAMEN1KMT2A | |
| SCHEMBL19717560 | 0.69 | AKR1B1 (0.41) | MAOBMAOAMEN1KMT2A | |
| SCHEMBL1767268 | 0.67 | MAOB (0.36) | MAOBMAOAOPRM1OPRK1OPRL1 | |
| Bromide SCHEMBL28969840 | 0.67 | OPRM1 (0.64) | MAOBMAOAOPRM1OPRK1OPRL1 | |
| Biphenyl SCHEMBL19717525 | 0.67 | ALDH1A1 (0.56) | MAOBMAOATAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113072420-B | 2-aryl substituted gem-difluoro cyclobutane compounds and preparation method thereof | 中山大学 | 2022-05-20 | — | — | CN | disclosed |
| CN-113072420-A | 2-aryl substituted gem-difluoro cyclobutane compounds and preparation method thereof | 中山大学 | 2021-07-06 | — | — | CN | disclosed |