Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.34 |
| ▸ | MAOB | P27338 | 3/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CMKLR1 | Q99788 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6983448 | 0.78 | MAOA (0.39) | MAOAESR1ESR2RAB9ACYP1A2 | |
| SCHEMBL6985896 | 0.77 | MAOA (0.44) | MAOACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL6992467 | 0.74 | MAOA (0.48) | MAOACYP3A4 | |
| SCHEMBL6986780 | 0.72 | MAOA (0.40) | MAOARAB9A | |
| SCHEMBL6716154 | 0.70 | GSTP1 (0.48) | MAOAMAOBRAB9ACYP1A2CYP2C19 | |
| SCHEMBL6986039 | 0.66 | GAA (0.41) | MAOAESR1RAB9ACYP1A2 | |
| SCHEMBL6986047 | 0.66 | MAOA (0.43) | MAOARAB9A | |
| SCHEMBL13651006 | 0.66 | MAOA (0.60) | MAOA | |
| SCHEMBL6986057 | 0.66 | MAOA (0.40) | MAOAESR1ESR2CYP3A4 | |
| SCHEMBL6983460 | 0.65 | MAOA (0.39) | MAOA |
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 |
|---|---|---|---|---|---|---|---|
| US-8183378-B2 | Ligands, their preparation and uses thereof in asymmetric reactions | Li, Chao-Jun (CA) | 2012-05-22 | — | — | US | disclosed |