Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6532974 | 0.84 | LIPG (0.42) | MTNR1ALIPGCYP2D6ALDH1A1CYP1A2 | |
| SCHEMBL28633850 | 0.82 | MAOA (0.47) | MAOAMAOBCYP1A1MTNR1ALIPG | |
| SCHEMBL27483096 | 0.80 | MTNR1A (0.41) | CYP1A1MTNR1ALIPGCYP2D6CYP3A4 | |
| SCHEMBL5997602 | 0.78 | MAOA (0.46) | MAOAMAOBMTNR1A | |
| SCHEMBL28472210 | 0.78 | MAOA (0.46) | MAOAMAOBCYP1A1MTNR1ALIPG | |
| SCHEMBL27323570 | 0.76 | MAOA (0.38) | MAOAMAOBMTNR1AALDH1A1 | |
| SCHEMBL2950500 | 0.76 | MAOA (0.50) | MAOAMAOBCYP1A1CYP2D6ALDH1A1 | |
| SCHEMBL28222763 | 0.75 | LIPG (0.46) | CYP1A1MTNR1ALIPGALOX5PTGS2 | |
| SCHEMBL11534238 | 0.74 | ALOX5 (0.48) | CYP1A1MTNR1ALIPGCYP2D6CYP3A4 | |
| SCHEMBL29432879 | 0.74 | LIPG (0.49) | CYP1A1MTNR1ALIPGALOX5PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-11214636-B2 | Rigid non-cyclopentadienyl group 4 transition metal and rare earth metal catalysts for olefin polymerization | MCMASTER UNIVERSITY (CA) | 2022-01-04 | — | — | US | disclosed |
| US-20200308322-A1 | RIGID NON-CYCLOPENTADIENYL GROUP 4 TRANSITION METAL AND RARE EARTH METAL CATALYSTS FOR OLEFIN POLYMERIZATION | MCMASTER UNIVERSITY (CA) | 2020-10-01 | — | — | US | disclosed |