Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | CALML3 | P27482 | 4/20 | 0.47 |
| ▸ | GRM2 | Q14416 | 7/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14270039 | 1.00 | MAOA (0.53) | MAOAMAOBCALML3GRM2 | |
| SCHEMBL12939664 | 1.00 | MAOA (0.53) | MAOAMAOBCALML3GRM2 | |
| SCHEMBL1712049 | 0.85 | MAOA (0.56) | MAOAMAOBCALML3GRM2 | |
| SCHEMBL1712046 | 0.85 | MAOA (0.56) | MAOAMAOBCALML3GRM2 | |
| SCHEMBL16696387 | 0.85 | MAOA (0.56) | MAOAMAOBCALML3GRM2 | |
| SCHEMBL14183680 | 0.85 | MAOA (0.56) | MAOAMAOBCALML3GRM2 | |
| SCHEMBL14270038 | 0.83 | GRM2 (0.46) | GRM2 | |
| SCHEMBL12939662 | 0.83 | GRM2 (0.46) | GRM2 | |
| SCHEMBL9969453 | 0.83 | GRM2 (0.46) | GRM2 | |
| SCHEMBL16093346 | 0.83 | MAOA (0.53) | MAOAMAOBCALML3GRM2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8841263-B2 | Macrocyclic compounds and methods of making and using the same | MELINTA THERAPEUTICS, INC. (US) | 2014-09-23 | — | — | US | disclosed |
| US-8841263-B2 | Macrocyclic compounds and methods of making and using the same | MELINTA THERAPEUTICS, INC. (US) | 2014-09-23 | — | — | US | disclosed |
| US-8202843-B2 | Macrocyclic compounds and methods of making and using the same | RIB-X PHARMACEUTICALS, INC. (US) | 2012-06-19 | — | — | US | disclosed |
| US-8202843-B2 | Macrocyclic compounds and methods of making and using the same | RIB-X PHARMACEUTICALS, INC. (US) | 2012-06-19 | — | — | US | disclosed |